Shanghai AoBo Bio-pharmaceutical Technology Co., Ltd

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Profile: Shanghai AoBo Bio-Pharmaceutical Technology Co., Ltd. is engaged in researching, developing, manufacturing and marketing of new pharmaceuticals and advanced intermediates and providing advanced technology services. We have the advantage of using multi-step synthesis technology and paying attention to researching and developing new technology through proprietary intellectual property rights. We specialize at developing drugs for antidepressants, antiviruses and cardiovascular purposes. We are also experienced in refining, separation and impurity control. We have currently researched and developed about twenty API projects including Temocapril HCL, with ten new projects in process.

Shanghai AoBo Bio-Pharmaceutical Technology Co., Ltd. was established in June 2004 and is located in "Chinese Medicine Valley". Our R&D center is staffed with highly educated and experienced professionals and is 900 m2, with five synthesis labs, two scale-up pilot labs and one analytical lab.

Shanghai AoBo provides technical services for medical companies, chemical enterprises and trade companies at home and abroad. Our synthesis staff can provide technical services for research of organic chemistry in Aobo and can be engaged in routine organic reactions, anhydrous reactions, hydrogenation, oxidation, amination and more. We are fully equipped with more than ten glass reactors from 5L to 50L, two 20L rotary devaporizers combined with low-temperature cooling liquid circulating pump (30L, -40°), and ten 2L rotary devaporizers combined with low-temperature cooling liquid circulating pump (5L, -20°). We specialize in synthesis of reagents, pharmaceutical intermediates, reference standards and impurities from milligram scale to kilograms scale. Shanghai AoBo also has the production capacity for APIs and pharmaceutical intermediates with ranges from mere kilos to tens of tons per month using our parent company's work shops.

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• Butyl Pyruvate

IUPAC Name: butyl 2-oxopropanoate | CAS Registry Number: 20279-44-1
Synonyms: Butyl pyruvate, Butyl 2-oxopropanoate, AC1LAYNX, butyl 2-oxidanylidenepropanoate, 2-oxopropanoic acid butyl ester, CTK4E3733, 2-oxo-propionic acid butyl ester, MolPort-001-788-414, Propanoic acid, 2-oxo-,butyl ester, ZINC02507111, AKOS006280003, AG-E-48530, AK110827, KB-48512, P531, FT-0651645, ST51055360, A814375, I14-6122, Pyruvicacid, butyl ester (6CI,7CI,8CI);2-Ketopropanoic acid butyl ester;Butylpyruvate;n-Butyl pyruvate;

Molecular Formula:	C₇H₁₂O₃	Molecular Weight:	144.168380 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	3

InChIKey: ZAZUOXBHFXAWMD-UHFFFAOYSA-N

• Butyl Triethyl Ammonium Bromide

IUPAC Name: butyl(triethyl)azanium | CAS Registry Number: 13028-69-8
Synonyms: ZINC01999085, CID45719

Molecular Formula:	C₁₀H₂₄N+	Molecular Weight:	158.304260 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	0

InChIKey: MPDDDPYHTMZBMG-UHFFFAOYSA-N

• Butyl-2-propynyl Ester Carbamic Acid

IUPAC Name: prop-2-ynyl N-butylcarbamate | CAS Registry Number: 76114-73-3
Synonyms: PROPARGYL BUTYLCARBAMATE, Prop-2-yn-1-yl butylcarbamate, AG-H-03635, Prop-2-ynyl N-butylcarbamate, N-Butyl propargyl carbamate, CTK5E2492, MolPort-020-001-068, AKOS006240963, N-butylcarbamic acid prop-2-ynyl ester, Carbamic acid, butyl-, 2-propynyl ester, AK113802, P633, KB-259372, Carbamic acid,N-butyl-, 2-propyn-1-yl ester, Carbamic acid, N-butyl-, 2-propyn-1-yl ester, A838613, 864493-71-0, Carbamicacid, butyl-, 2-propynyl ester (9CI);2-Propynyl butylcarbamate;N-Butylpropargyl carbamate;Propargyl butylcarbamate;

Molecular Formula:	C₈H₁₃NO₂	Molecular Weight:	155.194320 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	2

InChIKey: JTDBXHIIVZZXDH-UHFFFAOYSA-N

• Butylamines

IUPAC Name: butan-1-amine | CAS Registry Number: 109-73-9
Synonyms: Butylamine, 1-Butanamine, 1-Aminobutane, Monobutylamine, butan-1-amine, Norvalamine, N-BUTYLAMINE, Mono-n-butylamine, N-Butylamin, Butanamine, 1-Aminobutan, 1-Butylamine, 1-Amino-butaan, n-Butylamin [German], n-Butilamina [Italian], 1-Aminobutan [German], FEMA Number 3130, 1-Amino-butaan [Dutch], Monobutilamina [Romanian], BUTYLAMINE, N

Molecular Formula:	C₄H₁₁N	Molecular Weight:	73.136840 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	1

InChIKey: HQABUPZFAYXKJW-UHFFFAOYSA-N

• Butylated Hydroxy methyl phenol

IUPAC Name: 2,6-ditert-butyl-4-(hydroxymethyl)phenol | CAS Registry Number: 88-26-6
Synonyms: BHT alcohol, Antioxidant 754, Ionox 100, Ionox 100 antioxidant, Butylated hydroxymethylphenol, 3,5-Di-tert-butyl-4-hydroxybenzyl alcohol, CCRIS 7069, AO 754, 446424_ALDRICH, 3,5-Di-t-butyl-4-hydroxybenzyl alcohol, EINECS 201-815-6, CID6929, di-tert-Butyl-4-hydroxymethyl phenol, 2,6-Di-tert-butyl-4-hydroxymethylphenol, 2,6-Di-t-butyl-4-hydroxymethylphenol, NSC 159133, BRN 2052291, 2,6-Di-tert-butyl-4-(hydroxymethyl)phenol, NSC159133, SBB008243

Molecular Formula:	C₁₅H₂₄O₂	Molecular Weight:	236.349860 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	2

InChIKey: HNURKXXMYARGAY-UHFFFAOYSA-N

• Butylmesylate

IUPAC Name: butyl methanesulfonate | CAS Registry Number: 1912-32-9
Synonyms: Butyl mesylate, n-Butyl methanesulfonate, Butyl methanesulfonate, Butyl methanesulphonate, Methyl sulphonoxy butane, 2-Butyl methanesulfonate, n-Butylmethanesulfonate, METHANESULFONIC ACID, BUTYL ESTER, BUTANE, METHYLSULFONYLOXY-, CCRIS 9160, EINECS 217-620-4, NSC 36060, CID15953, NSC36060, BRN 1753437, AI3-50049, LS-45928, LS-90313, 4-04-00-00014 (Beilstein Handbook Reference), 63732-28-5

Molecular Formula:	C₅H₁₂O₃S	Molecular Weight:	152.211980 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	3

InChIKey: LFLBHTZRLVHUQC-UHFFFAOYSA-N

• Butylpyridinium bromide

IUPAC Name: 1-butylpyridin-1-ium;bromide | CAS Registry Number: 874-80-6
Synonyms: 1-Butylpyridinium bromide, 1-butylpyridin-1-ium bromide, ACMC-209qnu, N-Butylpyridinium bromide, SureCN382846, AC1MC0O8, DSSTox_CID_27909, DSSTox_RID_82662, DSSTox_GSID_47933, KSC491C7L, 00285_FLUKA, CTK3J1175, MolPort-020-002-009, Tox21_200610, ANW-38824, AKOS015833019, AG-H-53078, NCGC00258164-01, CAS-874-80-6, K561

Molecular Formula:	C₉H₁₄BrN	Molecular Weight:	216.118160 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	1

InChIKey: KVBQNFMTEUEOCD-UHFFFAOYSA-M

• Butylpyridinium chloride

IUPAC Name: 1-butylpyridin-1-ium | CAS Registry Number: 1124-64-7
Synonyms: n-Butylpyridinium, Pyridinium, 1-butyl-, n-Butylpyridinium chloride, CID193832, ZINC02528007, 45806-95-9

Molecular Formula:	C₉H₁₄N+	Molecular Weight:	136.214160 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	0

InChIKey: REACWASHYHDPSQ-UHFFFAOYSA-N

• Butylsulfonyl Chloride

IUPAC Name: butane-1-sulfonyl chloride | CAS Registry Number: 2386-60-9
Synonyms: 1-Butanesulfonyl chloride, Butylsulfonyl chloride, Butanesulfonyl chloride, 1-Butylsulfonyl chloride, n-Butanesulphonyl chloride, Butane-1-sulfonyl chloride, n-Butanesulfonyl chloride, Butane-1-sulphonyl chloride, 263605_ALDRICH, NSC 8027, EINECS 219-204-8, NSC8027, BRN 1748742, LS-45991, LS-45992, EK5940000, 4-04-00-00045 (Beilstein Handbook Reference)

Molecular Formula:	C₄H₉ClO₂S	Molecular Weight:	156.631060 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	2

InChIKey: WEDIIKBPDQQQJU-UHFFFAOYSA-N

• Butyltriphenylphosphonium bromide

IUPAC Name: butyl(triphenyl)phosphanium bromide | CAS Registry Number: 1779-51-7
Synonyms: N-Butyltriphenylphosphonium bromide, Phosphonium, butyltriphenyl-, bromide, n-Butyltriphenylphosphonium chloride, butyl triphenyl phosphine bromide, EINECS 217-219-4, NSC 59684, NSC59684, CID159628, LS-106882, ST5406326, TL8001421, 22949-84-4

Molecular Formula:	C₂₂H₂₄BrP	Molecular Weight:	399.303721 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	1

InChIKey: IKWKJIWDLVYZIY-UHFFFAOYSA-M

• Butyramide

IUPAC Name: butanamide | CAS Registry Number: 541-35-5
Synonyms: Butanamide, n-Butyramide, Butanimidic acid, N-BUTYLAMIDE, Butanoic acid, amide, Amide C4, n-C3H7C(O)NH2, 19240_FLUKA, CHEBI:50724, HSDB 5684, NSC8424, NSC 8424, EINECS 208-776-4, ZINC01586734, DB02121, AI3-24199, BMD, 42861-32-5

Molecular Formula:	C₄H₉NO	Molecular Weight:	87.120360 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	1

InChIKey: DNSISZSEWVHGLH-UHFFFAOYSA-N

• Butyramidine

IUPAC Name: 4-(4-amino-4-imino-2-methylbutyl)diazenyl-3-methylbutanimidamide hydrochloride | CAS Registry Number: 64037-73-6
Synonyms: Azobis isobutyramide hydrochloride, CID115706, LS-47742, Butyramidine, 4,4'-azobis(beta-methyl-, hydrochloride, Butanimidamide, 4,4'-azobis(3-methyl-, monohydrochloride

Molecular Formula:	C₁₀H₂₃ClN₆	Molecular Weight:	262.782820 [g/mol]
H-Bond Donor:	5	H-Bond Acceptor:	6

InChIKey: YVZBPXUQDYMOQL-UHFFFAOYSA-N

• Butyric acid hydrazide

IUPAC Name: butanehydrazide | CAS Registry Number: 3538-65-6
Synonyms: Butanohydrazide, Butyrohydrazide, Butyrylhydrazine, n-Butyric acid hydrazide, ARONIS010643, ALBB-002745, CID77079, NSC24021, NSC41957, EINECS 222-579-0, ZINC01608800, ST5409920

Molecular Formula:	C₄H₁₀N₂O	Molecular Weight:	102.135000 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	2

InChIKey: FCCCRBDJBTVFSJ-UHFFFAOYSA-N

• Butyryl choline chloride

IUPAC Name: 2-butanoyloxyethyl(trimethyl)azanium chloride | CAS Registry Number: 2963-78-2
Synonyms: Butyrylcholine chloride, Butrylcholine chloride, Choline, chloride, butyrate, MLS000069502, MLS001148612, NSC70378, Choline, chloride, butyrate (8CI), EINECS 220-999-9, NSC 70378, SMR000058617, 2-Butyryloxyethyltrimethylammonium chloride, B-9570, Ethanaminium, N,N,N-trimethyl-2-(1-oxobutoxy)-, chloride, Ethanaminium, N,N,N-trimethyl-2-(1-oxobutoxy)-, chloride (9CI), 3922-86-9

Molecular Formula:	C₉H₂₀ClNO₂	Molecular Weight:	209.713600 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	3

InChIKey: VCOBYGVZILHVOO-UHFFFAOYSA-M

• Butyrylcholine bromide

IUPAC Name: 2-butanoyloxyethyl(trimethyl)azanium | CAS Registry Number: 18956-84-8
Synonyms: butyrylcholine, Choline, butyrate (ester), Choline, butyrate (ester) (8CI), NCGC00018149-01, NCGC00163216-01, LS-65172, N,N,N-Trimethyl-2-(1-oxobutoxy)ethanaminium, BA 51-090059, Ethanaminium, N,N,N-trimethyl-2-(1-oxobutoxy)-, Ethanaminium, N,N,N-trimethyl-2-(1-oxobutoxy)- (9CI), 20292-68-6, 2494-56-6, 2963-78-2, 3922-86-9

Molecular Formula:	C₉H₂₀NO₂+	Molecular Weight:	174.260600 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	2

InChIKey: YRIBGSCJIMXMPJ-UHFFFAOYSA-N

• Cadmium diethyldithiocarbamate

IUPAC Name: cadmium(2+); N,N-diethylcarbamodithioate | CAS Registry Number: 14239-68-0
Synonyms: Cadmium bis(diethyldithiocarbamate)

Molecular Formula:	C₁₀H₂₀CdN₂S₄	Molecular Weight:	408.950200 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	2

InChIKey: QQOALHQRKUYNIC-UHFFFAOYSA-L

• Cafesterol

Synonyms: cafestol, Ambap1060, CCRIS 1518, CID108052, LS-185962, C09066, 5a,8-Methano-5aH-cyclohepta(5,6)naphtho(2,1-b)furan-7-methanol, 3b,4,5,6,7,8,9,10,10a,10b,11,12-dodecahydro-7-hydroxy-10b-methyl-, (3bS,5aS,7R,8R,10aR,10bS)-, 5a,8-Methano-5aH-cyclohepta(5,6)naphtho(2,1-b)furan-7-methanol, 3b,4,5,6,7,8,9,10,10a,10b,11,12-dodecahydro-7-hydroxy-10b-methyl-, (3bS-(3balpha,5abeta,7beta,8beta,10aalpha,10bbeta))-, (3bS,5aS,7R,8R,10aR,10bS)-7-(hydroxymethyl)-10b-methyl-3b,4,5,6,7,8,9,10,10a,10b,11,12-dodecahydro-5a,8-methanocyclohepta[5,6]naphtho[2,1-b]furan-7-ol

Molecular Formula:	C₂₀H₂₈O₃	Molecular Weight:	316.434520 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	3

InChIKey: DNJVYWXIDISQRD-HWUKTEKMSA-N

• Caffeic Acid

IUPAC Name: (E)-3-(3,4-dihydroxyphenyl)prop-2-enoic acid | CAS Registry Number: 331-39-5
Synonyms: caffeic acid, trans-Caffeate, 3,4-Dihydroxycinnamic acid, trans-caffeic acid, Caffeic acid polymer, Cinnamic acid, 3,4-dihydroxy-, 3,4-Dihydroxy-trans-cinnamate, CCRIS 847, 3,4-Dihydroxybenzeneacrylic acid, 3,4-Dihydroxy-cinnamic acid, HSDB 7088, MLS000069738, MLS001076493, C0625_SIGMA, SPECTRUM1503987, ARONIS023304, C9H8O4, NSC57197, 3-(3,4-Dihydroxyphenyl)propenoic acid, 60018_FLUKA

Molecular Formula:	C₉H₈O₄	Molecular Weight:	180.157420 [g/mol]
H-Bond Donor:	3	H-Bond Acceptor:	4

InChIKey: QAIPRVGONGVQAS-DUXPYHPUSA-N

• Caftaric acid

IUPAC Name: (2R,3R)-2-[(E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy-3-hydroxybutanedioic acid | CAS Registry Number: 67879-58-7
Synonyms: Monocaffeyltartaric acid, CID6440397, 72880-50-3, Butanedioic acid, 2-(3-(3,4-dihydroxyphenyl)-1-oxo-2-propenyl)-3-hydroxy-, (R-(R*,R*-(E)))-

Molecular Formula:	C₁₃H₁₂O₉	Molecular Weight:	312.228980 [g/mol]
H-Bond Donor:	5	H-Bond Acceptor:	9

InChIKey: SWGKAHCIOQPKFW-JTNORFRNSA-N

• Calcifediol

IUPAC Name: (1S,3Z)-3-[(2E)-2-[(1R,3aS,7aR)-1-[(2R)-6-hydroxy-6-methylheptan-2-yl]-7a-methyl-2,3,3a,5,6,7-hexahydro-1H-inden-4-ylidene]ethylidene]-4-methylidenecyclohexan-1-ol | CAS Registry Number: 19356-17-3
Synonyms: Calcidiol, 25-hydroxyvitamin D3, 25-Hydroxyvitamin D, Calcifediol anhydrous, 25-Hydroxycholecalciferol, Spectrum5_001931, 25-(OH)Vitamin D3, Vitamin D, 25-hydroxy-, BSPBio_001411, Cholecalciferol, 25-hydroxy-, H4014_SIGMA, 17938_FLUKA, CHEBI:17933, 5,6-cis-25-Hydroxyvitamin D3, 25-Hydroxyvitamin D3 monohydrate, AIDS001782, 25(OH)D3, AIDS-001782, LMST03020246, 1,25-DIHYDROXYCHOLECALCIFEROL

Molecular Formula:	C₂₇H₄₄O₂	Molecular Weight:	400.637060 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	2

InChIKey: JWUBBDSIWDLEOM-DTOXIADCSA-N

• Calcifediol Monohydrate

IUPAC Name: (1S,3Z)-3-[(2E)-2-[(1R,3aS,7aR)-1-[(2R)-6-hydroxy-6-methylheptan-2-yl]-7a-methyl-2,3,3a,5,6,7-hexahydro-1H-inden-4-ylidene]ethylidene]-4-methylidenecyclohexan-1-ol hydrate | CAS Registry Number: 63283-36-3
Synonyms: Calcifediol, Calderol, Calcifediol hydrate, Calderol (TN), Calcifediol monohydrate, Calcifediol (USP/INN), Calcifediol [USAN:INN:BAN], CID6441383, D00122, 9,10-Secocholesta-5,7,10(19)-triene-3,25-diol, monohydrate, (3beta,5Z,7E)-

Molecular Formula:	C₂₇H₄₆O₃	Molecular Weight:	418.652340 [g/mol]
H-Bond Donor:	3	H-Bond Acceptor:	3

InChIKey: WRLFSJXJGJBFJQ-WPUCQFJDSA-N

• Calciferol

IUPAC Name: (1S,3Z)-3-[(2E)-2-[(1R,3aS,7aR)-1-[(E,2R,5R)-5,6-dimethylhept-3-en-2-yl]-7a-methyl-2,3,3a,5,6,7-hexahydro-1H-inden-4-ylidene]ethylidene]-4-methylidenecyclohexan-1-ol | CAS Registry Number: 50-14-6
Synonyms: ergocalciferol, Viosterol, Calciferolum, Crystallina, Mulsiferol, Condocaps, Deltalin, Ercalciol, Ergorone, Fortodyl, Hyperkil, Mykostin, Radiostol, Radsterin, Sterogyl, Vigantol, Davitin, Deratol, Detalup, Diactol

Molecular Formula:	C₂₈H₄₄O	Molecular Weight:	396.648360 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	1

InChIKey: MECHNRXZTMCUDQ-RKHKHRCZSA-N

• Calcitonin

Synonyms: Cibacalcin, Miacalcin, Calcimar, Fortical, Salmon calcitonin, Osseocalcina, Prontocalcin, Bionocalcin, Calcihexal, Calcimonta, Calcitonina, Calcitoran, Cibacalcine, Eptacalcin, Miracalcic, Ostostabil, Porostenina, Rulicalcin, Salmocalcin, Tonocalcin

Molecular Formula:	C₁₄₅H₂₄₀N₄₄O₄₈S₂	Molecular Weight:	3431.853100 [g/mol]
H-Bond Donor:	52	H-Bond Acceptor:	56

InChIKey: BBBFJLBPOGFECG-UHFFFAOYSA-N

• Calcitriol

IUPAC Name: (1R,3S,5Z)-5-[(2E)-2-[(1R,3aS,7aR)-1-[(2R)-6-hydroxy-6-methylheptan-2-yl]-7a-methyl-2,3,3a,5,6,7-hexahydro-1H-inden-4-ylidene]ethylidene]-4-methylidenecyclohexane-1,3-diol | CAS Registry Number: 32222-06-3
Synonyms: calcitriol, Rocaltrol, Calcijex, Topitriol, Soltriol, Vectical, Asentar, Silkis, vit D, Rocaltrol (TN), Dihydroxyvitamin D3, 1,25-Dihydroxyvitamin D, Ambap3896, 1db1, 1alpha,25-Dihydroxyvitamin D3, Spectrum5_002061, Calcitriolum [INN-Latin], 1alpha,25(OH)2D3, 1,25-Dihydroxyvitamin D3, 1alpha,25(OH)2-D3

Molecular Formula:	C₂₇H₄₄O₃	Molecular Weight:	416.636460 [g/mol]
H-Bond Donor:	3	H-Bond Acceptor:	3

InChIKey: GMRQFYUYWCNGIN-NKMMMXOESA-N

• Calcium 2-keto-D-gluconate

IUPAC Name: calcium;3,4,5,6-tetrahydroxy-2-oxohexanoate | CAS Registry Number: 3470-37-9
Synonyms: 2-Keto-D-gluconic acid, 28098-92-2, 2-KETOGLUCONIC ACID, CA SALT, 2-KETO-D-GLUCONIC ACID HEMICALCIUM SALT, D-Arabino-2-hexulopyranosonic acid hemicalcium salt, [(3,4,5,6-tetrahydroxy-2-oxohexanoyl)oxy]calcio 3,4,5,6-tetrahydroxy-2-oxohexanoate

Molecular Formula:	C₁₂H₁₈CaO₁₄	Molecular Weight:	426.340920 [g/mol]
H-Bond Donor:	8	H-Bond Acceptor:	14

InChIKey: NNLOHLDVJGPUFR-UHFFFAOYSA-L

• Calcium Butyrate

IUPAC Name: calcium butanoate | CAS Registry Number: 5743-36-2
Synonyms: Calcium dibutyrate, CALCIUM BUTYRATE, EINECS 227-265-7, CID6453483

Molecular Formula:	C₈H₁₄CaO₄	Molecular Weight:	214.272360 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	4

InChIKey: FYPVXEILSNEKOO-UHFFFAOYSA-L

• Calcium Dobesilate Monohydrate

IUPAC Name: calcium 2,5-dihydroxybenzenesulfonate | CAS Registry Number: 20123-80-2
Synonyms: Doxium, Dexium, Rasexinium, Toraxine, Nugatex, Dobesilate calcium, Calcii dobesilas, Dobesilato calcico, Doxi-OM, CALCIUM DOBESILATE, Doxium (TN), Dobesilate de calcium, Calcium Dobesilate [INN], Calcium hydrochinonsulfonat, Calcium dobesilate (INN), Hydroquinone calcium sulfonate, Dobesilato di calcio [DCIT], Calcii dobesilas [INN-Latin], C6H5O5S, 2,5-Dihydroxybenzenesulfonate

Molecular Formula:	C₁₂H₁₀CaO₁₀S₂	Molecular Weight:	418.409800 [g/mol]
H-Bond Donor:	4	H-Bond Acceptor:	10

InChIKey: QGNBTYAQAPLTMX-UHFFFAOYSA-L

• Calcium Folinate

IUPAC Name: calcium (2S)-2-[[4-[(2-amino-5-formyl-4-oxo-1,6,7,8-tetrahydropteridin-6-yl)methylamino]benzoyl]amino]pentanedioate | CAS Registry Number: 1492-18-8
Synonyms: Wellcovorin, calcium folinate, Lederfoline, Calcium leucovorin, Uzel, LEUCOVORIN CALCIUM, Folinate-SF Calcium, Wellcovorin (TN), Prestwick_224, Folinic acid calcium salt, Leucovorin calcium salt, Calcium citrovorum factor, Uzel (TN), Leucovorin Calcium [USAN], Calcii folinas [INN-Latin], Leucovorin calcium (USP), Calcium folinate (JP15), Folinic acid-SF, calcium salt, Calcium 5-formyltetrahydrofolate, Folinato calcico [INN-Spanish]

Molecular Formula:	C₂₀H₂₁CaN₇O₇	Molecular Weight:	511.501440 [g/mol]
H-Bond Donor:	5	H-Bond Acceptor:	11

InChIKey: KVUAALJSMIVURS-ZEDZUCNESA-L

• Calcium Glycerophosphate

IUPAC Name: calcium 1,3-dihydroxypropan-2-yl phosphate | CAS Registry Number: 27214-00-2
Synonyms: calcium glycerophosphate, Calcium glycerophosphate (TN), Calcium glycerophosphate (JAN), CCRIS 1335, Calcium 1,3-hydroxypropyl phosphate, EINECS 248-328-5, EINECS 261-240-1, Calcium Glycerophosphate [USAN:JAN], LS-192469, D01488, Glycerol, mono(dihydrogen phosphate), calcium salt (1:1), 1,2,3-Propanetriol, 2-(dihydrogen phosphate), calcium salt (1:1), 1,2,3-Propanetriol, mono(dihydrogen phosphate), calcium salt (1:1), 17181-54-3, 58409-70-4

Molecular Formula:	C₃H₇CaO₆P	Molecular Weight:	210.135841 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	6

InChIKey: UHHRFSOMMCWGSO-UHFFFAOYSA-L

• Calcium HMB

IUPAC Name: 3-hydroxy-3-methylbutanoate | CAS Registry Number: 135236-72-5
Synonyms: ZINC00395642, CID6950804

Molecular Formula:	C₅H₉O₃-	Molecular Weight:	117.123160 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	3

InChIKey: AXFYFNCPONWUHW-UHFFFAOYSA-M

• Calcium L-Aspartate

IUPAC Name: calcium (2S)-2-aminobutanedioate | CAS Registry Number: 21059-46-1
Synonyms: Calciretard, calcium l-aspartate, Calcium aspartate, Asparaginate calcium, Calcium-L-aspartate, Ca-1-d1-aspartate, Calcium L-aspartate [JAN], EINECS 244-185-8, ASPARTIC ACID, CALCIUM SALT, L-, LS-22080, C13058, 56-84-8

Molecular Formula:	C₄H₅CaNO₄	Molecular Weight:	171.164800 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	5

InChIKey: OPSXJNAGCGVGOG-DKWTVANSSA-L

• Calcium L-Threonate

IUPAC Name: calcium;(2R,3S)-2,3,4-trihydroxybutanoate;hydrate | CAS Registry Number: 70753-61-6
Synonyms: PubChem21064, AKOS015924824

Molecular Formula:	C₈H₁₆CaO₁₁	Molecular Weight:	328.284040 [g/mol]
H-Bond Donor:	7	H-Bond Acceptor:	11

InChIKey: BEASIMXNQNRJRM-YKSMAXERSA-L

• Calcium Lactate

IUPAC Name: calcium 2-hydroxypropanoate | CAS Registry Number: 814-80-2
Synonyms: calcium lactate, Calphosan, Calcet, Conclyte calcium, Calcium dilactate, Mixture Name, Hemicalcium L-lactate, Calcium Lactate [USAN:JAN], Calcium lactate pentahydrate, CCRIS 3669, HSDB 976, calcium bis(2-hydroxypropanoate), Lactic acid, calcium salt (2:1), Calcium 2-hydroxypropanoate (1:2), EINECS 212-406-7, 2-Hydroxypropanoic acid calcium salt, AIDS004155, AIDS-004155, AI3-04468, LS-2396

Molecular Formula:	C₆H₁₀CaO₆	Molecular Weight:	218.218000 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	6

InChIKey: MKJXYGKVIBWPFZ-UHFFFAOYSA-L

• Calcium Magnesium Phytate

IUPAC Name: calcium magnesium (2,3,4,5,6-pentaphosphonatooxycyclohexyl) phosphate | CAS Registry Number: 3615-82-5
Synonyms: Inositocalcium, Phytocalcium, Phytophosphine, Inophosphan, Forglesan, Phosbiose, Eviunis, Phytin, Fosforo de Angeli, Calcium-magnesium phytate, Phytic acid calcium magnesium salt, EINECS 222-798-1, LS-84063, myo-Inositol, hexakis(dihydrogen phosphate), calcium magnesium salt, INOSITOL, HEXAKIS(DIHYDROGEN PHOSPHATE), CALCIUM MAGNESIUM SALT, myo-, 16059-99-7

Molecular Formula:	C₆H₆CaMgO₂₄P₆-₈	Molecular Weight:	712.323006 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	24

InChIKey: JWJNVODPOMYTLT-UHFFFAOYSA-B

• Calcium Pantothenate

IUPAC Name: calcium 3-[[(2R)-2,4-dihydroxy-3,3-dimethylbutanoyl]amino]propanoate | CAS Registry Number: 137-08-6
Synonyms: Calpan, calcium pantothenate, Vitamin- B5, Calpan (TN), Calcium D-pantothenate, 47867_SUPELCO, P5155_SIGMA, C8731_SIAL, P2250_SIAL, P5710_SIAL, 21210_FLUKA, D-Pantothenic acid hemicalcium salt, Calcium pantothenate (JP15/USP/INN), D01082, (R)-()-N-(2,4-Dihydroxy-3,3-dimethyl-1-oxobutyl)-beta-alanine hemicalcium salt

Molecular Formula:	C₁₈H₃₂CaN₂O₁₀	Molecular Weight:	476.532080 [g/mol]
H-Bond Donor:	6	H-Bond Acceptor:	10

InChIKey: FAPWYRCQGJNNSJ-UBKPKTQASA-L

• calcium pantothenic hydrate

IUPAC Name: calcium 3-[[(2R)-2,4-dihydroxy-3,3-dimethylbutanoyl]amino]propanoate hydrate | CAS Registry Number: 63409-48-3
Synonyms: Prestwick_821, Pantothenic acid calcium salt monohydrate, CID6420025

Molecular Formula:	C₁₈H₃₄CaN₂O₁₁	Molecular Weight:	494.547360 [g/mol]
H-Bond Donor:	7	H-Bond Acceptor:	11

InChIKey: KUKRZUPDYACRAM-GXIDORRSSA-L

• Calcium Phosphoryl Choline Chloride

IUPAC Name: calcium 2-(trimethylazaniumyl)ethyl phosphate chloride | CAS Registry Number: 4826-71-5
Synonyms: Trans-colin, Calcium phosphocholine chloride, Phosphorylcholine calcium salt, Phosphorylcholine calcium chloride, Calcium phosphocholine tetrahydrate, EINECS 239-610-9, PHOSPHORYL CHOLINE CHLORIDE, Choline chloride O-(calcium phosphate), EINECS 225-403-0, CALCIUM PHOSPHORYLCHOLINE CHLORIDE, LS-53198, Choline, chloride, dihydrogen phosphate calcium, Choline, chloride, dihydrogen phosphate calcium (8CI), Choline, chloride, dihydrogen phosphate calcium, tetrahydrate, Ethanaminium, N,N,N-trimethyl-2-(phosphonooxy)-, chloride calcium, Ethanaminium, N,N,N-trimethyl-2-(phosphonooxy)-, chloride calcium salt, tetrahydrate, Ethanaminium, N,N,N-trimethyl-2-(phosphonooxy)-, chloride calcium (9CI), Trimethyl(2-(phosphonooxy)ethyl)ammonium chloride, calcium salt (1:1), 15557-11-6, 72556-74-2

Molecular Formula:	C₅H₁₃CaClNO₄P	Molecular Weight:	257.665781 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	5

InChIKey: ICVPTJCCKTXCDT-UHFFFAOYSA-L

• Calcium phthalate hydrate

IUPAC Name: calcium phthalate | CAS Registry Number: 5793-85-1
Synonyms: Calcium phthalate, CID79857, EINECS 227-332-0, 88-99-3

Molecular Formula:	C₈H₄CaO₄	Molecular Weight:	204.192960 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	4

InChIKey: PYSZASIZWHHPHJ-UHFFFAOYSA-L

• Calcium Propionate

IUPAC Name: calcium propanoate | CAS Registry Number: 4075-81-4
Synonyms: Mycoban, Bioban-C, Calcium propanoate, Calcium dipropionate, calcium dipropanoate, CALCIUM PROPIONATE, Caswell No. 151, Propanoic acid, calcium salt, Propionic acid, calcium salt, HSDB 907, 2C3H5O2.Ca, EINECS 223-795-8, EPA Pesticide Chemical Code 077701, LS-2409

Molecular Formula:	C₆H₁₀CaO₄	Molecular Weight:	186.219200 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	4

InChIKey: BCZXFFBUYPCTSJ-UHFFFAOYSA-L

• Calcium Pyruvate

IUPAC Name: calcium 2-oxopropanoate | CAS Registry Number: 52009-14-0
Synonyms: Calcium pyruvate, EINECS 257-599-9

Molecular Formula:	C₃H₃CaO₃+	Molecular Weight:	127.132120 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	3

InChIKey: QJYMFPMPYYGIJD-UHFFFAOYSA-M

• Calcium Thiocyanate

IUPAC Name: calcium dithiocyanate | CAS Registry Number: 2092-16-2
Synonyms: Thiocyan, Calcium rhodanate, Calcium thiocyanate, Calcium sulfocyanate, Calcium dithiocyanate, Calciumrhodanid [German], Thiocyanic acid, calcium salt, EINECS 218-244-3, CALCIUM THIOCYANATE, 62%, Thiocyanic acid, calcium salt (2:1), LS-152637, 14778-33-7

Molecular Formula:	C₂CaN₂S₂	Molecular Weight:	156.242800 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	4

InChIKey: RLDQYSHDFVSAPL-UHFFFAOYSA-L

• Calycanthine

Synonyms: Ambap7450, Prestwick3_000595, BSPBio_000470, MLS002153896, BPBio1_000518, CHEBI:3333, NSC99016, EINECS 209-857-7, NSC 99016, SMR001233245, AB00513866, C10573, (1S,2R,10S,11R)-21,24-dimethyl-3,12,21,24-tetraazahexacyclo[9.7.3.3(2,10).0(1,10).0(4,9).0(13,18)]tetracosa-4,6,8,13,15,17-hexaene, (4bS,5R,10bS,11R)-13,18-dimethyl-5,6,11,12-tetrahydro-5,10b:11,4b-di(epiminoethano)dibenzo[c,h]-2,6-naphthyridine

Molecular Formula:	C₂₂H₂₆N₄	Molecular Weight:	346.468640 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	4

InChIKey: XSYCDVWYEVUDKQ-GXRSIYKFSA-N

• Camphane

IUPAC Name: 4,7,7-trimethylbicyclo[2.2.1]heptane | CAS Registry Number: 38451-93-3
Synonyms: Bornane, Bornylane, 464-15-3, 1,7,7-Trimethylbicyclo[2.2.1]heptane, 1beta,4beta-bornane, 1,7,7-Trimethylbicyclo(2.2.1)heptane, Bicyclo[2.2.1]heptane, 1,7,7-trimethyl-, BEWYHVAWEKZDPP-UHFFFAOYSA-N, SBB061847, (1s,4s)-1,7,7-trimethylbicyclo[2.2.1]heptane, CAE, NSC 17531, Bornane (8CI), 1|A,4|A-bornane, AC1L3NFJ, AC1Q2RKI, CHEBI:35783, CHEBI:41341, CTK4I9366, DTXSID60196832

Molecular Formula:	C₁₀H₁₈	Molecular Weight:	138.254 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	0

InChIKey: BEWYHVAWEKZDPP-UHFFFAOYSA-N

• Camphene-liquid

IUPAC Name: 6,6-dimethyl-5-methylidenebicyclo[2.2.1]heptane | CAS Registry Number: 79-92-5
Synonyms: CAMPHENE, Comphene, L-Camphene, 2,2-Dimethyl-3-methylenenorbornane, 3,3-Dimethyl-2-methylenenorbornane, FEMA No. 2229, 3,3-Dimethyl-2-methylenenorcamphane, CCRIS 3783, HSDB 900, Camphene, (1R,4S)-(+)-, CHEBI:3830, NSC 4165, EINECS 201-234-8, EINECS 209-275-3, 3,3-Dimethyl-2-methylenenorcamphene, NSC4165, EINECS 227-337-8, 2,2-Dimethyl-3-methylenebicyclo[2.2.1]heptane, AI3-01775, LS-2612

Molecular Formula:	C₁₀H₁₆	Molecular Weight:	136.234040 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	0

InChIKey: CRPUJAZIXJMDBK-UHFFFAOYSA-N

• Camphorquinone

IUPAC Name: (1R,4S)-1,7,7-trimethylbicyclo[2.2.1]heptane-2,3-dione | CAS Registry Number: 10373-78-1
Synonyms: ()-Camphorquinone, 2,3-Bornanedione, Ambap5942, DL-CAMPHORQUINONE, (1R)-(-)-Camphorquinone, (1R)-bornane-2,3-dione, 124893_ALDRICH, CHEBI:36778, CID641916, ZINC01555410, 1,7,7-Trimethylbicyclo[2.2.1]heptane-2,3-dione, Bicyclo[2.2.1]heptane-2,3-dione, 1,7,7-trimethyl-, (1R)-1,7,7-trimethylbicyclo[2.2.1]heptane-2,3-dione, (1R,4S)-1,7,7-trimethylbicyclo[2.2.1]heptane-2,3-dione, InChI=1/C10H14O2/c1-9(2)6-4-5-10(9,3)8(12)7(6)11/h6H,4-5H2,1-3H, 10334-26-6, 465-29-2

Molecular Formula:	C₁₀H₁₄O₂	Molecular Weight:	166.216960 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	2

InChIKey: VNQXSTWCDUXYEZ-LDWIPMOCSA-N

• Camptothecin

Synonyms: camptothecin, Camptothecine, d-Camptothecin, (S)-Camptothecin, (+)-Camptothecin, (+)-Camptothecine, 20(S)-Camptothecine, 20(S)-Camptothecin, Camptothecine (8CI), Prestwick_102, (S)-(+)-Camptothecin, Camptothecine (S,+), Spectrum_000299, Tocris-1100, (S)-()-Camptothecin, SpecPlus_000712, Prestwick0_000200, Prestwick1_000200, Prestwick2_000200, Prestwick3_000200

Molecular Formula:	C₂₀H₁₆N₂O₄	Molecular Weight:	348.352040 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	5

InChIKey: VSJKWCGYPAHWDS-FQEVSTJZSA-N

• Canadine

Synonyms: dl-Canadine, Xanthopuccine, Canadin, Tetrahydroberberine, Canadine dl-form, Berberine, tetrahydro-, Prestwick_186, (+)-Canadine, (+-)-Tetrahydroberberine, (.+-.)-Canadine, (-)-Tetrahydroberberine, canadine, (+-)-isomer, Prestwick0_000672, Prestwick1_000672, Prestwick2_000672, Prestwick3_000672, (d,l)-Tetrahydroberberine, CANADINE (DL-), CANADINE, (+-)-, Canadine, (.+-.)-

Molecular Formula:	C₂₀H₂₁NO₄	Molecular Weight:	339.385040 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	5

InChIKey: VZTUIEROBZXUFA-UHFFFAOYSA-N

• Candesartan

IUPAC Name: 2-ethoxy-3-[[4-[2-(2H-tetrazol-5-yl)phenyl]phenyl]methyl]benzimidazole-4-carboxylic acid | CAS Registry Number: 139481-59-7
Synonyms: candesartan, Blopress, Blopress (TN), Candesartan [BAN], Candesartan cilexetil, Candesartan [USAN:INN], Candesartan (USAN/INN), CHEBI:3347, C24H20N6O3, CV 11974, CV-11974, CV11974, DB00796, NCGC00167474-01, LS-32740, SL-00802, TL8000897, C07468, D00522, C081643

Molecular Formula:	C₂₄H₂₀N₆O₃	Molecular Weight:	440.454000 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	9

InChIKey: HTQMVQVXFRQIKW-UHFFFAOYSA-N

• Candesartan cilexetil

IUPAC Name: 1-cyclohexyloxycarbonyloxyethyl 2-ethoxy-3-[[4-[2-(2H-tetrazol-5-yl)phenyl]phenyl]methyl]benzimidazole-4-carboxylate | CAS Registry Number: 145040-37-5
Synonyms: Atacand, Blopress, Parapres, Kenzen, Amias, Ratacand, Candesartan hexetil, Atacand (TN), Candesartan celexetil, ATACAND HCT, Blopress 16 mg Plus, Spectrum_001707, Spectrum2_000485, Spectrum3_000996, Spectrum4_001124, Spectrum5_001462, TCV-116, Candesartan cilexetil [USAN], TCV 116, BSPBio_002691

Molecular Formula:	C₃₃H₃₄N₆O₆	Molecular Weight:	610.659660 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	12

InChIKey: GHOSNRCGJFBJIB-UHFFFAOYSA-N

• Canrenone

IUPAC Name: 10,13-dimethylspiro[2,8,9,11,12,14,15,16-octahydro-1H-cyclopenta[a]phenanthrene-17,5'-oxolane]-2',3-dione | CAS Registry Number: 976-71-6
Synonyms: Aldadiene, Phanurane, CANRENONE, Spirolactone SC 14266, NSC261713, AIDS128317, AIDS-128317, SC 9376, SC-9376, RP 11641, 11614 R. P., 17-Hydroxy-3-oxo-17.alpha.-pregna-4,6-diene-21-carboxylic acid .gamma.-lactone, 17.alpha.-Pregna-4,6-diene-21-carboxylic acid, 17-hydroxy-3-oxo-, .gamma.-lactone, Pregna-4,6-diene-21-carboxylic acid, 17-hydroxy-3-oxo-, .gamma.-lactone (17.alpha.)-, Pregna-4,6-diene-21-carboxylic acid, 17-hydroxy-3-oxo-, .gamma.-lactone, (17.alpha.)-, 17.alpha.-(2-Carboxyethyl)-17.beta.-hydroxyandrosta-4, 6-dien-3-one lactone, 17.alpha.-(2-Carboxyethyl)-17.beta.-hydroxyandrosta-4,6-dien-3-one lactone, Pregna-4, 6-diene-21-carboxylic acid, 17-hydroxy-3-oxo-, .gamma.-lactone, (17.alpha.)-

Molecular Formula:	C₂₂H₂₈O₃	Molecular Weight:	340.455920 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	3

InChIKey: UJVLDDZCTMKXJK-UHFFFAOYSA-N