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Profile: ChromaDex Inc. is a supplier of botanical reference standards along with related phytochemical products and services. We provide products and services to food, pharmaceutical, personal care, and dietary supplement markets. We also deal with botanical drugs, fine chemicals, nutraceuticals, pharmaceutical production plant and equipment.

1 to 50 of 322 Products/Chemicals (Click for related suppliers)  Page: [1] 2 3 4 5 6 7 >> Next 50 Results
• A-Butyrolactone
IUPAC Name: oxolan-2-one | CAS Registry Number: 96-48-0
Synonyms: gamma-Butyrolactone, 4-Butyrolactone, Butyrylactone, Butyryl lactone, BUTYROLACTONE, 4-Butanolide, 1,2-Butanolide, 1,4-Butanolide, 2-Oxolanone, gamma-BL, 4-Deoxytetronic acid, Butyric acid lactone, Agrisynth BLO, BLON, butyrl lactone, Dihydro-2-furanone, dihydrofuran-2(3H)-one, Tetrahydro-2-furanone, gamma-Butanolactone, 1,4-Lactone

Molecular Formula: C4H6O2Molecular Weight: 86.089240 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: YEJRWHAVMIAJKC-UHFFFAOYSA-N

• A-Carotene
IUPAC Name: 1,5,5-trimethyl-6-[(1E,3E,5E,7E,9E,11E,13E,15E,17E)-3,7,12,16-tetramethyl-18-(2,6,6-trimethylcyclohexen-1-yl)octadeca-1,3,5,7,9,11,13,15,17-nonaenyl]cyclohexene | CAS Registry Number: 7488-99-5
Synonyms: ALPHA-CAROTENE, Hi-Alpha, beta,epsilon-Carotene, (+)-alpha-Carotene, all-trans-alpha-Carotene, alpha-Carotene (natural), .beta.,.epsilon.-Carotene, alpha-Carotene, all-trans-, (6'R)-beta,epsilon-Carotene, .alpha.-Carotene, all-trans-, CCRIS 6294, .beta.,.epsilon.-Carotene, neo, CHEBI:28425, beta,epsilon-Carotene, (6'R)-, LMPR01070258, NCGC00181744-01, C05433, 4',5'-Didehydro-5',6'-dihydro-beta,beta-carotene, 432-70-2, (all-E)-1,3,3-Trimethyl-2-(3,7,12,1-tetramethyl-18-(2,6,6-trimethyl-2-cyclohexen-1-yl)-1,3,5,7,9,11,13,15,17-octadecanonaenyl)cyclohexene

Molecular Formula: C40H56Molecular Weight: 536.872640 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: ANVAOWXLWRTKGA-JLTXGRSLSA-N

• a-Ketoleucine Calcium Salt
IUPAC Name: 4-methyl-2-oxopentanoic acid | CAS Registry Number: 51828-95-6
Synonyms: 2-Oxoisocaproate, Ketoleucine, 2-ketoisocaproate, alpha-oxoisocaproate, alpha-ketoisocaproate, Isopropylpyruvic acid, 4-methyl-2-oxopentanoate, 4-Methyl-2-oxovaleric acid, 2-Oxoisocaproic acid, 4-methyl-2-oxopentanoic acid, alpha-Ketoisocaproic acid, 2-oxo-4-methylpentanoate, 2-keto-4-methyl-pentanoate, 2K-4CH3-PENTANOATE, 2-KETOISOCAPROIC ACID, 2-OXO-4-METHYLPENTANOIC ACID, Calcium 4-methyl-2-oxovalerate, 68255_FLUKA, CHEBI:48430, Pentanoic acid, 4-methyl-2-oxo-

Molecular Formula: C6H10O3Molecular Weight: 130.141800 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: BKAJNAXTPSGJCU-UHFFFAOYSA-N

• Abietic Acid
IUPAC Name: (1R,4aR,4bR,10aR)-1,4a-dimethyl-7-propan-2-yl-2,3,4,4b,5,6,10,10a-octahydrophenanthrene-1-carboxylic acid | CAS Registry Number: 514-10-3
Synonyms: ABIETIC ACID, Abietate, Sylvic acid, l-Abietic acid, (-)-Abietic acid, Abietic acid, technical, Kyselina abietova [Czech], 7,13-Abietadien-18-oic acid, ABIETIC ACID, PRACT, Abieta-7,13-dien-18-oic acid, CCRIS 3183, A9424_SIGMA, NSC25149, 00010_FLUKA, CHEBI:28987, EINECS 208-178-3, NSC 25149, C20H30O2, 13-Isopropylpodocarpa-7,13-dien-15-oic acid, LMPR01040063

Molecular Formula: C20H30O2Molecular Weight: 302.451000 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: RSWGJHLUYNHPMX-ONCXSQPRSA-N

• Abscisic Acid
IUPAC Name: (2Z,4E)-5-[(1S)-1-hydroxy-2,6,6-trimethyl-4-oxocyclohex-2-en-1-yl]-3-methylpenta-2,4-dienoic acid | CAS Registry Number: 21293-29-8
Synonyms: Abscisin II, ABSCISIC ACID, Abscisate, Dormin, Dormin (VAN), (+)-Abscisic acid, ()-Abscisic acid, (S)-(+)-Abscisic acid, Ambap5078, Acide abscisique [French], Dormin (abscission factor), 2-cis,4-trans-Abscisic acid, cis-trans-(+)-Abscissic acid, A4906_SIGMA, CHEBI:2365, EINECS 244-319-5, NSC 146877, NSC 148832, BRN 2698956, SMP2_000105

Molecular Formula: C15H20O4Molecular Weight: 264.316900 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: JLIDBLDQVAYHNE-YKALOCIXSA-N

• Acacetin
IUPAC Name: 5,7-dihydroxy-2-(4-methoxyphenyl)chromen-4-one | CAS Registry Number: 480-44-4
Synonyms: acacetin, Linarigenin, Linarisenin, Acacetine, Buddleoflavonol, Akatsetin, 4'-Methoxyapigenin, Acaceztin, Prestwick_49, ACAETIN, Apigenin 4'-methyl ether, Apisenin 4'-methyl ether, 5,7-Dihydroxy-4'-methoxyflavone, Apigenin 4'-dimethyl ether, Spectrum_000135, 5,7-Dioxy-4'-methoxyflavone, Prestwick0_000695, Prestwick1_000695, Prestwick2_000695, Prestwick3_000695

Molecular Formula: C16H12O5Molecular Weight: 284.263480 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 5

InChIKey: DANYIYRPLHHOCZ-UHFFFAOYSA-N

• Acetaminophen
IUPAC Name: N-(4-hydroxyphenyl)acetamide | CAS Registry Number: 103-90-2
Synonyms: acetaminophen, Paracetamol, Tylenol, Datril, Acetaminofen, Algotropyl, Naprinol, 4-Acetamidophenol, Lonarid, Panadol, Acamol, Anelix, Multin, APAP, p-Acetamidophenol, p-Acetaminophenol, Paracetamolo, Abensanil, Acetagesic, Acetalgin

Molecular Formula: C8H9NO2Molecular Weight: 151.162560 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: RZVAJINKPMORJF-UHFFFAOYSA-N

• Acetic Acid Benzyl Ester
IUPAC Name: phenylmethyl acetate | CAS Registry Number: 140-11-4
Synonyms: BENZYL ACETATE, Benzyl ethanoate, benzylacetate, Phenylmethyl acetate, Acetic acid, benzyl ester, Phenylmethyl ethanoate, alpha-Acetoxytoluene, Acetic acid, phenylmethyl ester, nchem.167-comp5, Caswell No. 081EA, Acetic acid benzyl ester, (Acetoxymethyl)benzene, Benzyl acetate (natural), .alpha.-Acetoxytoluene, ACETATO DE BENCILO, FEMA No. 2135, CCRIS 1423, NCI-C06508, WLN: 1VO1R, B15805_ALDRICH

Molecular Formula: C9H10O2Molecular Weight: 150.174500 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: QUKGYYKBILRGFE-UHFFFAOYSA-N

• Acetovanillone
IUPAC Name: 1-(4-hydroxy-3-methoxyphenyl)ethanone | CAS Registry Number: 498-02-2
Synonyms: apocynin, Acetoguaiacone, Apocynine, Acetoguaiacon, Acetovanilone, Acetovanyllon, Acetovanillon, 4-Acetyl-2-methoxyphenol, nchembio.83-comp20, 4'-Hydroxy-3'-methoxyacetophenone, 3-Methoxy-4-hydroxyacetophenone, Acetophenone, 4'-hydroxy-3'-methoxy-, CCRIS 7285, 1-(4-Hydroxy-3-methoxyphenyl)ethanone, 4-HYDROXY-3-METHOXYACETOPHENONE, WLN: 1VR DQ CO1, A10809_ALDRICH, Ethanone, 1-(4-hydroxy-3-methoxyphenyl)-, MLS001304972, W508454_ALDRICH

Molecular Formula: C9H10O3Molecular Weight: 166.173900 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: DFYRUELUNQRZTB-UHFFFAOYSA-N

• Acetyl Cysteine
IUPAC Name: (2R)-2-acetamido-3-sulfanylpropanoic acid | CAS Registry Number: 616-91-1
Synonyms: acetylcysteine, N-Acetyl-L-cysteine, N-Acetylcysteine, Broncholysin, Acetadote, Fluimucil, Mucomyst, Parvolex, Airbron, Mucosil, Brunac, Fabrol, mercapturic acid, L-Acetylcysteine, Fluimucetin, Flumucetin, Mucosolvin, Fluprowit, Lysomucil, Mucofilin

Molecular Formula: C5H9NO3SMolecular Weight: 163.194860 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: PWKSKIMOESPYIA-BYPYZUCNSA-N

• Acetyl-4-fluoro-DL-phenylalanine
IUPAC Name: (2R)-2-acetamido-3-(4-fluorophenyl)propanoic acid | CAS Registry Number: 17481-06-0
Synonyms: N-ACETYL-P-FLUOROPHENYLALANINE

Molecular Formula: C11H12FNO3Molecular Weight: 225.216283 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: NRLBRFQYMSTLJK-SNVBAGLBSA-N

• Acetyl-L-Carnitine HCL
IUPAC Name: 3-acetyloxy-4-(trimethylazaniumyl)butanoate hydrochloride | CAS Registry Number: 5080-50-2
Synonyms: o-Acetyl-L-carnitine hydrochloride, Acetylcarnitine L-form hydrochloride, 1-Propanaminium, 2-(acetyloxy)-3-carboxy-N,N,N-trimethyl-, chloride, (R)-

Molecular Formula: C9H18ClNO4Molecular Weight: 239.696520 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: JATPLOXBFFRHDN-UHFFFAOYSA-N

• Aconitine
Synonyms: aconitine, CHEBI:2430, NSC56464, STOCK1N-54397, CID245005, NCI60_004380, C06091, 16-Ethyl-1alpha,6alpha,19beta-trimethoxy-4-(methoxymethyl)-aconitane-3alpha,8,10alpha,11,18alpha-pentol, 8-acetate 10-benzoate, 20-ethyl-3alpha,13,15alpha-trihydroxy-1alpha,6alpha,16beta-trimethoxy-4-(methoxymethyl)aconitane-8,14alpha-diyl 8-acetate 14-benzoate

Molecular Formula: C34H47NO11Molecular Weight: 645.737080 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 12

InChIKey: XFSBVAOIAHNAPC-XTHSEXKGSA-N

• Adamantane
IUPAC Name: adamantane | CAS Registry Number: 281-23-2
Synonyms: ADAMANTANE, Adamantylidene, Adamantan, Adamantanylidene, Adamantane (8CI), Tricyclo(3.3.1.13,7)decane, tricyclo[3.3.1.1~3,7~]decane, Tricyclo[3.3.1.1(3,7)]decane, 100277_ALDRICH, CHEBI:40519, EINECS 206-001-4, CID9238, Tricyclo[3.3.1.13,7]decane, NSC 527913, NSC527913, Tricyclo[3.3.1.13,7]dec-2-yl, DB03627, Tricyclo(3.3.1.1(3,7))decylidene, LS-157064, ADM

Molecular Formula: C10H16Molecular Weight: 136.234040 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: ORILYTVJVMAKLC-UHFFFAOYSA-N

• Adenine
IUPAC Name: 7H-purin-6-amine | CAS Registry Number: 73-24-5
Synonyms: adenine, 6-Aminopurine, Adenin, Adeninimine, 1H-Purin-6-amine, Vitamin B4, Leuco-4, 2-aminopurine, Purine, 6-amino-, 9H-Purin-6-amine, Leucon, 6-Amino-1H-purine, 6-Amino-3H-purine, 6-Amino-7H-purine, 6-Amino-9H-purine, adenine-ring, Pedatisectine B, Adenine [JAN], 1jys, 1nli

Molecular Formula: C5H5N5Molecular Weight: 135.126700 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 5

InChIKey: GFFGJBXGBJISGV-UHFFFAOYSA-N

• Adenosine
IUPAC Name: (2R,3R,4S,5R)-2-(6-aminopurin-9-yl)-5-(hydroxymethyl)oxolane-3,4-diol | CAS Registry Number: 58-61-7
Synonyms: adenosine, Adenine riboside, Adenocard, Adenoscan, deoxyadenosine, Desoxyadenosine, Nucleocardyl, Sandesin, Boniton, Myocol, beta-Adenosine, beta-D-Adenosine, Adenine nucleoside, Polyadenosine, Adenosin, Adenyldeoxyriboside, Polyriboadenosine, Adenosin [German], adenine-D-ribose, 1odi

Molecular Formula: C10H13N5O4Molecular Weight: 267.241320 [g/mol]
H-Bond Donor: 4H-Bond Acceptor: 9

InChIKey: OIRDTQYFTABQOQ-KQYNXXCUSA-N

• Adonitol
IUPAC Name: (2S,4R)-pentane-1,2,3,4,5-pentol | CAS Registry Number: 488-81-3
Synonyms: adonitol, xylitol, Xylite, ribitol, Pentitol, Adonite, Xyliton, Adonit, Eutrit, Kannit, Klinit, Newtol, D-Xylitol, D-ribitol, meso-ribitol, meso-xylitol, Xylit, Xylite (sugar), L-arabitol, D-Adonitol

Molecular Formula: C5H12O5Molecular Weight: 152.145780 [g/mol]
H-Bond Donor: 5H-Bond Acceptor: 5

InChIKey: HEBKCHPVOIAQTA-NGQZWQHPSA-N

• Adrenal
IUPAC Name: 4-[(1R)-1-hydroxy-2-(methylamino)ethyl]benzene-1,2-diol | CAS Registry Number: 51-43-4
Synonyms: epinephrine, l-Adrenaline, adrenaline, Adrenalin, Levoepinephrine, L-epinephrine, Adrenalinum, Epinephran, Epipen, l-Epirenamine, Antiasthmatique, Methylarterenol, Esphygmogenina, Hypernephrin, Isoptoepinal, Racepinephrine, Renostypticin, Sphygmogenin, Stryptirenal, Supracapsulin

Molecular Formula: C9H13NO3Molecular Weight: 183.204420 [g/mol]
H-Bond Donor: 4H-Bond Acceptor: 4

InChIKey: UCTWMZQNUQWSLP-VIFPVBQESA-N

• Adrenochrome
IUPAC Name: 3-hydroxy-1-methyl-2,3-dihydroindole-5,6-dione | CAS Registry Number: 54-06-8
Synonyms: Adraxone, 1-Adrenochrome, USAF uctl-7, ADRENOCHROME, L-, C9H9NO3, A5752_SIGMA, 3-Hydroxy-1-methyl-5,6-indolinedione, EINECS 200-192-8, NSC407840, 3-Hydroxy-1-methylindoline-5,6-dione, NSC383491, NCGC00163348-01, LS-83454, 5,6-INDOLINEDIONE, 3-HYDROXY-1-METHYL-, A-3200, 2,3-Dihydro-3-hydroxy-1-methyl-1H-indole-5,6-dione, 1H-Indole-5,6-dione, 2,3-dihydro-3-hydroxy-1-methyl-, 1H-Indole-5,6-dione, 2,3-dihydro-3-hydroxy-1-methyl- (9CI), 7506-92-5

Molecular Formula: C9H9NO3Molecular Weight: 179.172660 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: RPHLQSHHTJORHI-UHFFFAOYSA-N

• Adrenosterone
IUPAC Name: (8S,9S,10R,13S,14S)-10,13-dimethyl-1,2,6,7,8,9,12,14,15,16-decahydrocyclopenta[a]phenanthrene-3,11,17-trione | CAS Registry Number: 382-45-6
Synonyms: ADRENOSTERONE, Reichstein's substance G, 11-Ketoandrostenedione, Prestwick0_000899, Prestwick1_000899, Prestwick2_000899, Prestwick3_000899, 11-Oxy-4-androstenedione, Androst-4-ene-3,11,17-trione, BSPBio_000718, MLS000028712, MLS001146874, SPBio_002927, 284998_ALDRICH, BPBio1_000790, 4-Androstene-3,11,17-trione, NSC12166, CID223997, NCGC00179466-01, SMR000059216

Molecular Formula: C19H24O3Molecular Weight: 300.392060 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: RZRPTBIGEANTGU-IRIMSJTPSA-N

• Aflatoxin B
Synonyms: AFLATOXIN B1, Aflatoxin-B1, AFBI, AFB1, CCRIS 12, HSDB 3453, HSDB-3453, Aflatoxin B1, cis(+,-)-Isomer, AIDS130418, AIDS-130418, EINECS 214-603-3, LMPK02000020, NSC529592, NSC 529592, NSC-529592, BRN 1269174, Aflatoxin B1, (6aR-cis)-Isomer, 2H-Labeled, Aflatoxin B1, (6aR-cis)-Isomer, 3H-Labeled, C06800, Aflatoxin B1 Dihydrochloride, (6aR-cis)-Isomer

Molecular Formula: C17H12O6Molecular Weight: 312.273580 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 6

InChIKey: OQIQSTLJSLGHID-UHFFFAOYSA-N

• Aflatoxin B2
Synonyms: Dihydroaflatoxin B1, AFLATOXIN B2, Aflatoxin B2 solution, 46324U_SUPELCO, A9887_SIGMA, 34034_RIEDEL, 34034_FLUKA, CPD-10177, ZINC00402720, CID2724360

Molecular Formula: C17H14O6Molecular Weight: 314.289460 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 6

InChIKey: WWSYXEZEXMQWHT-WNWIJWBNSA-N

• Aflatoxin G
Synonyms: Aflatoxin, AFLATOXIN G1, Aflatoxin, crude, AFLATOXINS, Aflatoxin G1 solution, CCRIS 14, 46325U_SUPELCO, HSDB 3455, A0138_SIGMA, 34032_RIEDEL, EINECS 214-615-9, HSDB 3411, CID14421, BRN 1299768, CPD-10178, LS-15307, LS-70763, 5-19-12-00081 (Beilstein Handbook Reference), (7AR,cis)3,4,7a,10a-tetrahydro-5-methoxy-1H,12H-furo(3',2':4,5)furo(2,3-h)pyrano(3,4-c)chromene-1,12-dione, 1H,12H-Furo(3',2':4,5)furo(2,3-h)pyrano(3,4-c)(1)benzopyran-1,12-dione, 3,4,7a,10a-tetrahydro-5-methoxy-

Molecular Formula: C17H12O7Molecular Weight: 328.272980 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 7

InChIKey: XWIYFDMXXLINPU-UHFFFAOYSA-N

• Aflatoxin G2
IUPAC Name: 3-[4-[(3-chlorophenyl)methoxy]phenyl]-5-(methoxymethyl)-1,3-oxazolidin-2-one | CAS Registry Number: 7241-98-7

Molecular Formula: C18H18ClNO4Molecular Weight: 347.792820 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: BHCOKYJYXDKTPG-UHFFFAOYSA-N

• Agaric Acid
IUPAC Name: 2-hydroxynonadecane-1,2,3-tricarboxylic acid | CAS Registry Number: 666-99-9
Synonyms: Agaricic acid, Agaricin, Agaric acid, Agaricinic acid, Laricic acid, Agaricinsaeure, alpha-Cetylcitric acid, n-Hexadecylcitric acid, .alpha.-Cetylcitric acid, A7384_SIGMA, NSC 60429, NSC 65690, NSC60429, NSC65690, EINECS 211-566-5, CHEBI:226878, CID12629, BRN 1729981, NCGC00167547-01, 2-Hydroxy-1,2,3-nonadecanetricarboxylic acid

Molecular Formula: C22H40O7Molecular Weight: 416.548800 [g/mol]
H-Bond Donor: 4H-Bond Acceptor: 7

InChIKey: HZLCGUXUOFWCCN-UHFFFAOYSA-N

• Agnuside
IUPAC Name: [(1S,4aR,5S,7aS)-5-hydroxy-1-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1,4a,5,7a-tetrahydrocyclopenta[c]pyran-7-yl]methyl 4-hydroxybenzoate | CAS Registry Number: 11027-63-7
Synonyms: MEGxp0_000767, ACon1_000039, CID442416, NCGC00168851-01, C09765, BRD-K25132901-001-01-5

Molecular Formula: C22H26O11Molecular Weight: 466.435240 [g/mol]
H-Bond Donor: 6H-Bond Acceptor: 11

InChIKey: GLACGTLACKLUJX-QNAXTHAFSA-N

• Albiflorin
Synonyms: 9-((Benzoyloxy)methyl)-1-(beta-D-glucopyranosyloxy)-4-hydroxy-6-methyl-7-oxatricyclononan-8-one

Molecular Formula: C23H28O11Molecular Weight: 480.461820 [g/mol]
H-Bond Donor: 5H-Bond Acceptor: 11

InChIKey: QQUHMASGPODSIW-RPLHGOISSA-N

• Albizzin
IUPAC Name: (2S)-2-amino-3-(carbamoylamino)propanoic acid | CAS Registry Number: 1483-07-4
Synonyms: Albizziin, L-Albizziine, Albizzine, L-Albizziin, Albizziin (VAN), 3-Ureido-L-alanin, L-beta-Ureidoalanine, Ambap7483, L-2-Amino-3-ureidopropionic acid, 861456_ALDRICH, EINECS 216-046-1, L-Alanine, 3-((aminocarbonyl)amino)-, NSC 132089, NSC 407273, L-(-)-2-Amino-3-ureidopropionic acid, Propionic acid, 2-amino-3-ureido-, L-, A-4650, C08264, L-(−)-2-Amino-3-ureidopropionic acid

Molecular Formula: C4H9N3O3Molecular Weight: 147.132560 [g/mol]
H-Bond Donor: 4H-Bond Acceptor: 4

InChIKey: GZYFIMLSHBLMKF-REOHCLBHSA-N

• Aldosterone
IUPAC Name: (8S,9S,10R,11S,13R,14S,17S)-11-hydroxy-17-(2-hydroxyacetyl)-10-methyl-3-oxo-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthrene-13-carbaldehyde | CAS Registry Number: 52-39-1
Synonyms: ALDOSTERONE, Electrocortin, Aldocortin, Elektrocortin, Aldocorten, Aldocortene, d-Aldosterone, Reichstein X, (+)-Aldosterone, 18-Oxocorticosterone, 18-Aldocorticosterone, Aldosteronum [INN-Latin], Aldosterona [INN-Spanish], MLS001333163, MLS001333164, A9477_SIGMA, Aldosterone [BAN:DCF:INN], Aldosterone [INN:BAN:DCF], NSC 73856, CHEBI:27584

Molecular Formula: C21H28O5Molecular Weight: 360.444020 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 5

InChIKey: PQSUYGKTWSAVDQ-ZVIOFETBSA-N

• Aleuritic Acid
IUPAC Name: 9,10,16-trihydroxyhexadecanoic acid | CAS Registry Number: 533-87-9
Synonyms: Aleuritic acid, Aleuritolic acid, alpha-Aleuritic acid, beta-Aleuritic acid, erythro-Aleuritic acid, Aleuritic acid (alpha), Aleuritic acid, tech, Synthetic aleuritic acid, Aleuritic acid, tech., DL-erythro-Aleuritic acid, (.+/-.)-Aleuritic acid, (+-)-erythro-Aleuritic acid, NSC 7668, EINECS 208-578-8, NSC7668, 9,10,16-Trihydroxyhexadecanoic acid, 9,10,16-Trihydroxypalmitic acid, AIDS014676, AIDS-014676, CID10790

Molecular Formula: C16H32O5Molecular Weight: 304.422280 [g/mol]
H-Bond Donor: 4H-Bond Acceptor: 5

InChIKey: MEHUJCGAYMDLEL-UHFFFAOYSA-N

• Alisol Acetate B
IUPAC Name: [1-(3,3-dimethyloxiran-2-yl)-3-[(8S,10S,11S,14R)-11-hydroxy-4,4,8,10,14-pentamethyl-3-oxo-1,2,5,6,7,9,11,12,15,16-decahydrocyclopenta[a]phenanthren-17-yl]butyl] acetate | CAS Registry Number: 26575-95-1
Synonyms: Alisol B 23-acetate, 23-O-Acetylalisol B, Alisol B 23-monoacetate, CID3084460, 26622-13-9, 8alpha,9beta,14beta-Dammar-13(17)-en-3-one, 24,25-epoxy-11beta,23-dihydroxy-, 23-acetate, (23S,24R)-, Dammar-13(17)-en-3-one, 23-(acetyloxy)-24,25-epoxy-11-hydroxy-, (8alpha,9beta,11beta,14beta,23S,24R)-

Molecular Formula: C32H50O5Molecular Weight: 514.736400 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 5

InChIKey: NLOAQXKIIGTTRE-CXWFPJGHSA-N

• Alisol B
IUPAC Name: (8S,9S,10S,11S,14R)-17-[(2R)-4-(3,3-dimethyloxiran-2-yl)-4-hydroxybutan-2-yl]-11-hydroxy-4,4,8,10,14-pentamethyl-1,2,5,6,7,9,11,12,15,16-decahydrocyclopenta[a]phenanthren-3-one | CAS Registry Number: 18649-93-9
Synonyms: CID189051

Molecular Formula: C30H48O4Molecular Weight: 472.699720 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: GBJKHDVRXAVITG-DXYWBWDESA-N

• Allantoin
IUPAC Name: (2,5-dioxoimidazolidin-4-yl)urea | CAS Registry Number: 97-59-6
Synonyms: allantoin, Glyoxyldiureide, Cordianine, 5-Ureidohydantoin, Glyoxyldiureid, Allantol, Alantan, Sebical, Cutemol emollient, Uniderm A, AVC/Dienestrolcream, Ureidohydantoin, Hemocane, Psoralon, Septalan, Paxyl, Hydantoin, 5-ureido-, DL-Allantoin, Caswell No. 024, Glyoxylic diureide

Molecular Formula: C4H6N4O3Molecular Weight: 158.115440 [g/mol]
H-Bond Donor: 4H-Bond Acceptor: 3

InChIKey: POJWUDADGALRAB-UHFFFAOYSA-N

• Alliin
IUPAC Name: (2R)-2-amino-3-prop-2-enylsulfinylpropanoic acid | CAS Registry Number: 556-27-4
Synonyms: SPECTRUM1505190, 3-(Allylsulphinyl)-L-alanine, CID87310, EINECS 241-773-6, C08265, 17795-26-5

Molecular Formula: C6H11NO3SMolecular Weight: 177.221440 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: XUHLIQGRKRUKPH-ITZCMCNPSA-N

• Allitridum
IUPAC Name: 3-prop-2-enylsulfinylsulfanylprop-1-ene | CAS Registry Number: 539-86-6
Synonyms: Allicin, Diallyl thiosulfinate, allimin, allylthiosulfinate, Diallyldisulfid-S-oxid, DADSO, diallyl disulfide-oxide, S-Allyl acrylo-1-sulphinothioate, Allylthiosulphinic acid allyl ester, C6H10OS2, CCRIS 9053, CID65036, CHEBI:28411, EINECS 208-727-7, Thio-2-propene-1-sulfinic acid S-allyl ester, AIDS097132, AIDS-097132, CPD-9275, S-allyl 2-propene-1-sulfinothioate, BRN 1752823

Molecular Formula: C6H10OS2Molecular Weight: 162.273000 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: JDLKFOPOAOFWQN-UHFFFAOYSA-N

• Allo-Purinol
IUPAC Name: 1,2-dihydropyrazolo[3,4-d]pyrimidin-4-one | CAS Registry Number: 315-30-0
Synonyms: allopurinol, Zyloprim, Lopurin, Zyloric, Uripurinol, Atisuril, Bleminol, Embarin, Foligan, Milurit, Progout, Urosin, Anoprolin, Cellidrin, Epidropal, Suspendol, Alositol, Apulonga, Bloxanth, Caplenal

Molecular Formula: C5H4N4OMolecular Weight: 136.111460 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: OFCNXPDARWKPPY-UHFFFAOYSA-N

• Allopregnandiol
IUPAC Name: (3S,5S,8R,9S,10S,13S,14S,17S)-17-[(1R)-1-hydroxyethyl]-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-ol | CAS Registry Number: 516-53-0
Synonyms: Allopregnane-3beta,20beta-diol, EINECS 208-223-7, ZINC04081539, (20R)-5alpha-Pregnane-3beta,20-diol

Molecular Formula: C21H36O2Molecular Weight: 320.509340 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: YWYQTGBBEZQBGO-XFHAOOBSSA-N

• allopregnandione
IUPAC Name: (5S,8R,9S,10S,13S,14S,17S)-17-acetyl-10,13-dimethyl-1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-one | CAS Registry Number: 566-65-4
Synonyms: 3,20-Allopregnanedione, 5alpha-Dihydroprogesterone, 5-alpha-Dihydroprogesterone, 3,20-Dioxo-5alpha-pregnane, 5alpha-Pregnane-3,20-dione, 5beta-Pregnane-3,20-dione, 5-alpha-Pregnane-3,20-dione, 5.alpha.-Dihydroprogesterone, 5.beta.-Pregnane-3,20-dione, 3,20-Dioxo-5.alpha.-pregnane, 5.alpha.-Pregnane-3,20-dione, CHEBI:28952, EINECS 209-297-3, NSC 18319, NSC18319, BRN 2058506, Pregnane-3,20-dione, (5alpha)-, Pregnane-3,20-dione, (5-alpha)-, 5alpha-Pregnane-3,20-dione (8CI), Pregnane-3,20-dione, (5.alpha.)-

Molecular Formula: C21H32O2Molecular Weight: 316.477580 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: XMRPGKVKISIQBV-BJMCWZGWSA-N

• Allopregnanolone
IUPAC Name: 1-[(3S,5S,8R,9S,10S,13S,14S,17S)-3-hydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]ethanone | CAS Registry Number: 516-55-2
Synonyms: Isopregnanolone, 3-beta-Allopregnanolone, 5-alpha-Dihydropregnenolone, Allopregnan-3beta-ol-20-one, 5alpha-Pregnan-3beta-ol-20-one, CHEBI:11909, EINECS 208-224-2, NSC 97078, 3beta-hydroxy-5alpha-pregnane-20-one, C21H34O2, 3-beta-Hydroxy-5-alpha-pregnan-20-one, 3beta-Hydroxy-5alpha-pregnan-20-one, Pregnanolone, (3beta, 5alpha)-isomer, 3beta-Hydroxy-5alpha-tetrahydroprogesterone, 5-alpha-Pregnan-20-one, 3-beta-hydroxy-, 5alpha-Pregnan-20-one, 3beta-hydroxy-, (3beta,5alpha)-3-hydroxypregnan-20-one, U 0949, LS-118574, C15484

Molecular Formula: C21H34O2Molecular Weight: 318.493460 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: AURFZBICLPNKBZ-FZCSVUEKSA-N

• Allyl Isothiocyanate
IUPAC Name: 3-isothiocyanatoprop-1-ene | CAS Registry Number: 57-06-7
Synonyms: Allylsenevol, ALLYL ISOTHIOCYANATE, Allylsevenolum, Allylsenfoel, Redskin, Senfoel, Oil Of mustard, Oleum sinapis, Allyspol, Carbospol, Allyl sevenolum, Allyl mustard oil, AITC, Volatile mustard oil, Allyl isosulfocyanate, Senf oel, Synthetic mustard oil, Oils, mustard, Allyspol 75EC, Allyl thioisocyanate

Molecular Formula: C4H5NSMolecular Weight: 99.154200 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: ZOJBYZNEUISWFT-UHFFFAOYSA-N

• Allyl methyl sulfide
IUPAC Name: 3-methylsulfanylprop-1-ene | CAS Registry Number: 10152-76-8
Synonyms: Allyl methyl sulphide, Sulfide, allyl methyl, Methyl allyl sulfide, methyl propenyl sulfide, 1-Propene, 3-(methylthio)-, 3-methylthio-1-propene, CCRIS 7066, NCIOpen2_003675, A34201_ALDRICH, EINECS 233-422-0, ZINC02015871, LS-123487, C077207

Molecular Formula: C4H8SMolecular Weight: 88.171320 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: NVLPQIPTCCLBEU-UHFFFAOYSA-N

• Allyl Sulphide
IUPAC Name: 3-prop-2-enylsulfanylprop-1-ene | CAS Registry Number: 592-88-1
Synonyms: Allyl sulfide, Allyl monosulfide, Thioallyl ether, DIALLYL SULFIDE, diallylsulfide, Garlic oil, Oil garlic, Diallyl thioether, Diallyl sulphide, Diallyl monosulfide, Allium sativum, Oil of garlic, Diallyl thioather, Oils, garlic, Dially monosulfide, 2-Propenyl sulphide, Allium sativum oil, 1-Propene, 3,3'-thiobis-, Essential oil of garlic, 3,3-Thiobis(1-propene)

Molecular Formula: C6H10SMolecular Weight: 114.208600 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: UBJVUCKUDDKUJF-UHFFFAOYSA-N

• Aloe-emodine
IUPAC Name: 1,8-dihydroxy-3-(hydroxymethyl)anthracene-9,10-dione | CAS Registry Number: 481-72-1
Synonyms: Aloe-emodin, Aloe emodin, Rhabarberone, emodin, Aloeemodin, aloe emodine, EMODINE, 3-Hydroxymethylchrysazin, Ambap3320, 3-Hydroxymethylchrysazine, CCRIS 3526, MLS000697563, A7687_SIGMA, NSC 38628, NSC38628, EINECS 207-571-7, AIDS048396, 1,8-Dihydroxy-3-hydroxymethylanthraquinone, AIDS-048396, C15H10O5

Molecular Formula: C15H10O5Molecular Weight: 270.236900 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 5

InChIKey: YDQWDHRMZQUTBA-UHFFFAOYSA-N

• Aloin
IUPAC Name: (10R)-1,8-dihydroxy-3-(hydroxymethyl)-10-[(2S,3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]-10H-anthracen-9-one | CAS Registry Number: 1415-73-2
Synonyms: aloin, Barbaloin, Aloinum, Aloin A, Aloin [BAN], EINECS 215-808-0, NSC 227189, NSC 631263, LS-185038, 10-(1',5'-Anhydroglucosyl)aloe-emodin-9-anthrone, C10305, 10-beta-D-Glucopyranosyl-1,8-dihydroxy-3-hydroxymethyl-9(10H)-anthrone,(R)-, 10-Glucopyranosyl-1,8-dihydroxy-3-(hydroxymethyl)-9(10H)-anthracenone, (R)-10-beta-D-Glucopyranosyl-1,8-dihydroxy-3-(hydroxymethyl)anthracen-9(10H)-one, 1,8-Dihydroxy-3-hydroxymethyl-10-(6-hydroxymethyl-3,4,5-trihydroxy-2-pyranyl)anthrone, 10-beta-D-Glucopyranosyl-1,8-dihydroxy-3-hydroxymethyl-9(10H)-anthrone, 10361-17-8, 11019-96-8, 25429-08-7, 31017-11-5

Molecular Formula: C21H22O9Molecular Weight: 418.393980 [g/mol]
H-Bond Donor: 7H-Bond Acceptor: 9

InChIKey: AFHJQYHRLPMKHU-WEZNYRQKSA-N

• Alpha-Amanitin
Synonyms: alpha-amanitin, alpha-Amanitine, alpha-Amatoxin, Amanitin, .alpha.-Amanitin, alpha-Amanitin, Amanita sp., CBiol_001932, HSDB 3458, A2263_SIGMA, BCBcMAP01_000054, EINECS 245-432-2, CID2100, AIDS004473, Bio1_000218, Bio1_000707, Bio1_001196, AIDS-004473, BRN 1071138, SMP1_000013, LS-16533

Molecular Formula: C39H54N10O14SMolecular Weight: 918.969660 [g/mol]
H-Bond Donor: 13H-Bond Acceptor: 14

InChIKey: CIORWBWIBBPXCG-UHFFFAOYSA-N

• alpha-Amyrin
IUPAC Name: (3S,4aR,6aR,6bS,8aR,11R,12S,12aR,14aR,14bR)-4,4,6a,6b,8a,11,12,14b-octamethyl-2,3,4a,5,6,7,8,9,10,11,12,12a,14,14a-tetradecahydro-1H-picen-3-ol | CAS Registry Number: 638-95-9
Synonyms: Viminalol, alpha-Amyrenol, alpha-Amyrine, .alpha.-Amyrin, .alpha.-Amyrenol, Urs-12-en-3beta-ol, 53017_FLUKA, (3.beta.)-Urs-12-en-3-ol, AIDS070313, AIDS-070313, CID73170, CPD-8250, EINECS 211-352-1, LMPR01060011, NSC 114787, Urs-12-en-3-ol, (3beta)- (9CI), ST5411384, C08615, (3S,4aR,6aR,6bS,8aR,11R,12S,12aR,14aR,14bR)-4,4,6a,6b,8a,11,12,14b-Octamethyl-1,2,3,4,4a,5,6,6a,6b,7,8,8a,9,10,11,12,12a,14,14a,14b-eicosahydro-picen-3-ol

Molecular Formula: C30H50OMolecular Weight: 426.717400 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: FSLPMRQHCOLESF-SFMCKYFRSA-N

• alpha-Boswellic acid
IUPAC Name: (6aR,6bS,8aR,12aR)-3-hydroxy-4,6a,6b,8a,11,11,14b-heptamethyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicene-4-carboxylic acid | CAS Registry Number: 471-66-9

Molecular Formula: C30H48O3Molecular Weight: 456.700320 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: BZXULBWGROURAF-SLLOXPBESA-N

• Alpinetin
IUPAC Name: (2S)-7-hydroxy-5-methoxy-2-phenyl-2,3-dihydrochromen-4-one | CAS Registry Number: 36052-37-6
Synonyms: (-)-alpinetin, CHEBI:518574, AIDS354121, AIDS-354121, CID154279, ZINC00338037, 4H-1-Benzopyran-4-one, 2,3-dihydro-7-hydroxy-5-methoxy-2-phenyl-, (2S)-, (2S)-7-Hydroxy-5-methoxy-2-phenyl-2,3-dihydro-4H-1-benzopyran-4-one

Molecular Formula: C16H14O4Molecular Weight: 270.279960 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: QQQCWVDPMPFUGF-ZDUSSCGKSA-N

• Alyssin
IUPAC Name: 1-isothiocyanato-5-methylsulfinylpentane | CAS Registry Number: 646-23-1
Synonyms: Ambap2371, CID206035, 1-Isothiocyanato-5-(methylsulfinyl)pentane, Pentane, 1-isothiocyanato-5-(methylsulfinyl)-

Molecular Formula: C7H13NOS2Molecular Weight: 191.314220 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: IUUQPVQTAUKPPB-UHFFFAOYSA-N

• Amaranth (C.I. No. 16185)
IUPAC Name: trisodium (4E)-3-oxo-4-[(4-sulfonatonaphthalen-1-yl)hydrazinylidene]naphthalene-2,7-disulfonate | CAS Registry Number: 915-67-3
Synonyms: Amaranthe, Lissamine, Amacid Amaranth, Amaranth red, Edicol Amaranth, Kayaku Amaranth, Rakuto Amaranth, Aizen Amaranth, Amaranth Extra, Maple Amaranth, Acid Amaranth, Amaranth Lake, Cranberry Red, Java Amaranth, Toyo Amaranth, Azorubine S, Dolkwal Amaranth, Hidacid Amaranth, Shikiso Amaranth, Takaoka Amaranth

Molecular Formula: C20H11N2Na3O10S3Molecular Weight: 604.473050 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 12

InChIKey: VOBHRQFELWTZFS-DXVNCNPQSA-K


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