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Medical Isotopes, Inc.

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Contact: Eric Stohler
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Profile: Medical Isotopes, Inc. manufactures stable isotope chemicals labeled with deuterium, C15, N15, O18 and metal isotopes. We offer deuterated vitamins and oxygen-18 water. We also deal with custom synthesis. We specialize in multi-step custom synthesis for pharmaceutical companies, government, research facilities and hospitals.

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• 22(S)-Hydroxycholesterol
IUPAC Name: (3S,8S,9S,10R,13S,14S,17R)-17-[(2S,3S)-3-hydroxy-6-methylheptan-2-yl]-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol | CAS Registry Number: 22348-64-7
Synonyms: 22-Hydroxycholesterol, 22beta-Hydroxycholesterol, H5884_SIGMA, CHEBI:1301, 5-Cholestene-3beta,22(S)-diol, MolPort-003-941-681, CID168038, (3beta,22S)-Cholest-5-ene-3,22-diol, (22S)-cholest-5-ene-3beta,22-diol, Cholest-5-ene-3,22-diol, (3beta,22S)-

Molecular Formula: C27H46O2Molecular Weight: 402.652940 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: RZPAXNJLEKLXNO-QUOSNDFLSA-N

• 7beta-Hydroxycholesterol-25,26,26,26-27,27,27-D7
IUPAC Name: (3S,7R,8S,9S,10R,13R,14S,17R)-10,13-dimethyl-17-[(2R)-5,6,6,6-tetradeuterio-5-(trideuteriomethyl)hexan-2-yl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene-3,7-diol | CAS Registry Number: 349553-97-5

Molecular Formula: C26H44O2Molecular Weight: 395.679 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: HKTLZNPSEKWWSW-KXSSCKPSSA-N

• 2'-Deoxyuridine-5,6-D2
IUPAC Name: 5,6-dideuterio-1-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrimidine-2,4-dione | CAS Registry Number: 40632-23-3

Molecular Formula: C9H12N2O5Molecular Weight: 230.216 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 5

InChIKey: MXHRCPNRJAMMIM-AQAQJVFASA-N

• 19-Hydroxyandrostendione-19-D2
IUPAC Name: (8R,9S,10S,13S,14S)-10-[dideuterio(hydroxy)methyl]-13-methyl-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthrene-3,17-dione | CAS Registry Number: 71995-64-7
Synonyms: 19-Hydroxy Androstendione-19-d2, NSC 74233-d2, Androst-4-en-19-ol-3,17-dione-d2, Androst-4-ene-3,17-dione-19-ol-d2, 19-Hydroxyandrost-4-ene-3,17-dione-19,19-d2

Molecular Formula: C19H26O3Molecular Weight: 304.420264 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: XGUHPTGEXRHMQQ-HLWDEJRRSA-N

• (+/-)-Metanephrine hydrochloride
IUPAC Name: 4-[1-hydroxy-2-(methylamino)ethyl]-2-methoxyphenol hydrochloride | CAS Registry Number: 881-95-8
Synonyms: Metanephrine HCl, Prestwick_906, Metanephrine hydrochloride, Metanephrine hydrochloride DL, (+-)-Metanephrine hydrochloride, EINECS 212-922-2, MolPort-003-958-856, Adrenaline, 3-methoxy-, hydrochloride, EINECS 225-809-8, CID102502, LS-30766, LT00451990, alpha-((Methylamino)methyl)vanillyl alcohol hydrochloride, (+-)-alpha-((Methylamino)methyl)vanillyl alcohol hydrochloride, Vanillyl alcohol, alpha-((methylamino)methyl)-, hydrochloride, (+-)-4-Hydroxy-3-methoxy-alpha-((methylamino)methyl)benzenemethanol hydrochloride, Benzenemethanol, 4-hydroxy-3-methoxy-alpha-((methylamino)methyl)-, hydrochloride, (+-)-, Vanillyl alcohol, alpha-((methylamino)methyl)-, hydrochloride (8CI), 5090-31-3

Molecular Formula: C10H16ClNO3Molecular Weight: 233.691940 [g/mol]
H-Bond Donor: 4H-Bond Acceptor: 4

InChIKey: HRIQFVCFOPJYEQ-UHFFFAOYSA-N

• 2-Chloroethyl-D4 methyl sulfide
IUPAC Name: 1-chloro-1,1,2,2-tetradeuterio-2-methylsulfanylethane | CAS Registry Number: 93709-60-5
Synonyms: 2-CHLOROETHYL-D4METHYLSULFIDE

Molecular Formula: C3H7ClSMolecular Weight: 114.630327 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: MYFKLQFBFSHBPA-RRVWJQJTSA-N

• (R)-Aminocarnitine
IUPAC Name: (3R)-3-amino-4-(trimethylazaniumyl)butanoate | CAS Registry Number: 98063-21-9
Synonyms: emeriamine, Aminocarnitine, 3-Amino-4-trimethylaminobutyric acid, CID121830, LS-186823, 1-Propanaminium, 2-amino-3-carboxy-N,N,N-trimethyl-, hydroxide, inner salt, (R)-

Molecular Formula: C7H16N2O2Molecular Weight: 160.214140 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: DAWBGYHPBBDHMQ-ZCFIWIBFSA-N

• (2s,3s)-1,2-epoxy-3-(boc-amino)-4-phenylbutane, Registry
IUPAC Name: tert-butyl N-[(1S)-1-[(2S)-oxiran-2-yl]-2-phenylethyl]carbamate | CAS Registry Number: 98737-29-2
Synonyms: (2S,3S)-1,2-Epoxy-3-(Boc-amino)-4-phenylbutane, (2S,3S)-N-t-Boc-3-amino-1,2-epoxy-4-phenylbutane, (2S,3S)-1,2-Epoxy-3-(tert-butoxycarbonylamino)-4-phenylbutane, tert-Butyl ((S)-1-((S)-oxiran-2-yl)-2-phenylethyl)carbamate, 286019-82-7, tert-Butyl [(S)-1-[(S)-Oxiran-2-yl]-2-phenylethyl]carbamate, Tert-butyl N-[(1S)-1-[(2S)-oxiran-2-yl]-2-phenyl-ethyl]carbamate, tert-Butyl [S-(R, KSC523O6B, 476951_ALDRICH, CTK4C3760, 143688-65-7, ACT02842, ANW-40956, ZINC02567352, AKOS015894820, AG-D-86388, AG-L-62739, BD23336, LS30114

Molecular Formula: C15H21NO3Molecular Weight: 263.332140 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: NVPOUMXZERMIJK-QWHCGFSZSA-N

• (2s, 3s)-3-amino-2-methyl-4-oxoazetidine-1-sulfonic Acid
IUPAC Name: (2S,3S)-3-amino-2-methyl-4-oxoazetidine-1-sulfonic acid | CAS Registry Number: 80082-65-1
Synonyms: 3-Amino-4-methylmonobactamic acid, EINECS 279-393-8, (2S-trans)-3-Amino-2-methyl-4-oxoazetidine-1-sulphonic acid

Molecular Formula: C4H8N2O4SMolecular Weight: 180.182320 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 5

InChIKey: ISUIVWNWEDIHJD-HRFVKAFMSA-N

• 3,5-Oxazolidinedicarboxylic acid, 2,2-dimethyl-4-phenyl-, 3-(1,1-dimethylethyl) ester, (4S,5R)-
IUPAC Name: (4S,5R)-2,2-dimethyl-3-[(2-methylpropan-2-yl)oxycarbonyl]-4-phenyl-1,3-oxazolidine-5-carboxylic acid | CAS Registry Number: 143527-70-2
Synonyms: (4S,5R)-3-(tert-Butoxycarbonyl)-2,2-dimethyl-4-phenyloxazolidine-5-carboxylic acid, SureCN286796, Jsp002556, CTK8B6068, MolPort-003-845-241, ANW-52397, SBB063406, AKOS015838260, AKOS015888976, AM84394, AK-25421, BR-25421, KB-70249, Q745, FT-0647934, (4S,5R)-3,5-Oxazolidinedicarboxylic acid-2,2-dimethyl-4-phenyl-3-(1,1-dimethylethyl)ester, (4S,5R)-3-(tert-butoxycarbonyl)-2,2-dimethyl-4-phenyl-1,3-oxazolidine-5-carboxylic acid, (4S,5R)-3,5-Oxazolidinedicarboxylic acid, 2,2-dimethyl-4-phenyl-3-(1,1-dimethylethyl)ester, 3,5-Oxazolidinedicarboxylic acid,2,2-dimethyl-4-phenyl-,3-(1,1-dimethylethyl)ester,(4S,5R)-

Molecular Formula: C17H23NO5Molecular Weight: 321.368220 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 5

InChIKey: VAHXMEZCPGHDBJ-QWHCGFSZSA-N

• 2,6-Benzothiazolediamine, 4,5,6,7-tetrahydro-, (6S)-
IUPAC Name: (6S)-4,5,6,7-tetrahydro-1,3-benzothiazole-2,6-diamine | CAS Registry Number: 106092-09-5
Synonyms: (s)-4,5,6,7-tetrahydro-2,6-benzothiazolediamine, (S)-4,5,6,7-Tetrahydro-benzothiazole-2,6-diamine, (s)-4,5,6,7-tetrahydrobenzo[d]thiazole-2,6-diamine, (S)-2,6-Diamino-4,5,6,7-tetrahydrobenzothiazole, AG-D-20340, (6S)-4,5,6,7-Tetrahydro-1,3-benzothiazol-2,6-diamine, (6S)-4,5,6,7-tetrahydro-1,3-benzothiazole-2,6-diamine, 2,6-benzothiazolediamine, 4,5,6,7-tetrahydro-, (6s)-, S-(-)-2,6-Diamino-4,5,6,7-tetrahydrobenzothiazole, PubChem14626, PubChem14627, UNII-J4N3Y41JML, 2,6-Benzothiazolediamine,4,5,6,7-tetrahydro-, (6S)-, KSC504I0B, Pramipexole related compound A, Jsp000560, CTK4A4400, MolPort-002-499-492, ACT07187, ANW-52357

Molecular Formula: C7H11N3SMolecular Weight: 169.247340 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: DRRYZHHKWSHHFT-BYPYZUCNSA-N

• (S)-Thalidomide
IUPAC Name: 2-[(3S)-2,6-dioxopiperidin-3-yl]isoindole-1,3-dione | CAS Registry Number: 841-67-8
Synonyms: (-)-Thalidomide, l-Thalidomide, thalidomide, Thalidomide, L-, S-(-)-Thalidomide, Tocris-0652, Lopac-T-144, MLS001333073, MLS001333074, CHEBI:442014, NSC 91730, CID92142, ZINC01530947, CAS-50-35-1, NCGC00015989-01, NCGC00016220-01, NCGC00024708-01, SMR000857221, LS-109465, Phthalimide, N-(2,6-dioxo-3-piperidyl)-, (-)-

Molecular Formula: C13H10N2O4Molecular Weight: 258.229500 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: UEJJHQNACJXSKW-VIFPVBQESA-N

• 2,4-Heptadien-1-Ol
IUPAC Name: (2E,4E)-hepta-2,4-dien-1-ol | CAS Registry Number: 33467-79-7
Synonyms: 2,4-Heptadien-1-ol, (E,E)-2,4-Heptadien-1-ol, 00146_FLUKA, ZINC02560463, 2,4-Heptadien-1-ol, (E,E)-, EINECS 251-535-3, (2E,4E)-Hepta-2,4-dien-1-ol, 2,4-Heptadien-1-ol, (2E,4E)-, CID5367391

Molecular Formula: C7H12OMolecular Weight: 112.169580 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: MDRZSADXFOPYOC-VNKDHWASSA-N

• 1,2:5,6-Di-O-Isopropylidene-Alpha-D-Ribo-3-Hexulofuranose
IUPAC Name: 5-(2,2-dimethyl-1,3-dioxolan-4-yl)-2,2-dimethyl-3a,6a-dihydrofuro[2,3-d][1,3]dioxol-6-one | CAS Registry Number: 2847-00-9
Synonyms: NSC623655, AIDS131381, AIDS-131381, CID360941, 5-(2,2-Dimethyl-[1,3]dioxolan-4-yl)-2,2-dimethyl-dihydro-furo[2,3-d][1,3]dioxol-6-one

Molecular Formula: C12H18O6Molecular Weight: 258.267720 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 6

InChIKey: QSRFRZJIRAOQSJ-UHFFFAOYSA-N

• (R)(-)-1-Phenyl-1,2-Ethanediol
IUPAC Name: (1S)-1-phenylethane-1,2-diol | CAS Registry Number: 16355-00-3
Synonyms: ()-Styrene glycol, 1-phenylethane-1,2-diol, 1-Phenyl-1,2-ethanediol, 1,2-Ethanediol, 1-phenyl-, (S)-()-Phenylethylene glycol, 302155_ALDRICH, TE5119, ZINC00391852, (S)-()-1-Phenyl-1,2-ethanediol, 93-56-1, InChI=1/C8H10O2/c9-6-8(10)7-4-2-1-3-5-7/h1-5,8-10H,6H

Molecular Formula: C8H10O2Molecular Weight: 138.163800 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: PWMWNFMRSKOCEY-MRVPVSSYSA-N

• 5-Aminoindole
IUPAC Name: 1H-indol-5-amine | CAS Registry Number: 5192-03-0
Synonyms: 1H-Indol-5-amine, Indol-5-ylamine, 5-Indolamine, Indole, 5-amino-, A59654_ALDRICH, NSC61452, 08245_FLUKA, CHEBI:33067, CID78867, EINECS 225-977-2, NSC 61452, SBB004219, ZINC00153906, SDCCGMLS-0066200.P001, TL8003435, A-5640

Molecular Formula: C8H8N2Molecular Weight: 132.162520 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: ZCBIFHNDZBSCEP-UHFFFAOYSA-N

• 5a-Pregnane-3,20-dione
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

• 1-Methyl-2,4(1H,3H)-pyrimidinedione
IUPAC Name: 1-methylpyrimidine-2,4-dione | CAS Registry Number: 615-77-0
Synonyms: 1-METHYLURACIL, Uracil, 1-methyl-, Uracil, 1-methyl- (8CI), 293768_ALDRICH, NSC44432, AIDS081806, 2,4(1H,3H)-Pyrimidinedione, 1-methyl-, AIDS-081806, NSC 44432, ZINC00409298, 1-methylpyrimidine-2,4(1H,3H)-dione, 2,4(1H,3H)-Pyrimidinedione, 1-methyl- (9CI), InChI=1/C5H6N2O2/c1-7-3-2-4(8)6-5(7)9/h2-3H,1H3,(H,6,8,9

Molecular Formula: C5H6N2O2Molecular Weight: 126.113340 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: XBCXJKGHPABGSD-UHFFFAOYSA-N

• (+)-O-Desmethyl Tramadol hydrochloride
IUPAC Name: 3-[(1R,2R)-2-[(dimethylamino)methyl]-1-hydroxycyclohexyl]phenol;hydrochloride | CAS Registry Number: 148262-77-5
Synonyms: O-Desmethyl Tramadol Hydrochloride, EM 723, 185453-02-5, (+)-O-Desmethyltramadol hydrochloride, (+)-O-Desmethyl Tramadol Hydrochloride, Phenol, 3-[(1R,2R)-2-[(dimethylamino)methyl]-1-hydroxycyclohexyl]-, hydrochloride (1:1), O-Desmethyltramadol HCl, UNII-XL5VDC061E, Phenol, 3-[2-[(dimet, SureCN2518899, O-demethyltramadol hydrochloride, CTK8G2151, AG-G-93444, FT-0666239, hylamino)methyl]-1-hydroxycyclohexyl]-, hydrochloride, (1R-cis)-, (1R-cis)-3-[2-[(Dimethylamino)methyl]-1-hydroxycyclohexyl]phenol Hydrochloride, 2-[(rel-1R, 2R)(Dimethylamino)methyl]-1-(m-hydroxyphenyl)cyclohexanol Hydrochloride, 3-[(1R,2R)-2-[(Dimethylamino)methyl]-1-hydroxycyclohexyl]phenol Hydrochloride, 3-[(rel-1R,2R)2-[(Dimethylamino)methyl]-1-hydroxycyclohexyl]phenol Hydrochloride, Phenol, 3-((1R,2R)-2-((dimethylamino)methyl)-1-hydroxycyclohexyl)-, hydrochloride, rel-

Molecular Formula: C15H24ClNO2Molecular Weight: 285.809560 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 3

InChIKey: IRGWVAWLHXDKIX-PBCQUBLHSA-N

• 1-Myristoyl-3-chloropropanediol
IUPAC Name: 1-chloro-3,3-dihydroxyheptadecan-4-one | CAS Registry Number: 30557-03-0
Synonyms: 1-MYRISTOYL-3-CHLOROPROPANEDIOL, CTK4G5408, KB-160122

Molecular Formula: C17H33ClO3Molecular Weight: 320.895120 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: AJKXGBYZSYGOGR-UHFFFAOYSA-N

• 7alpha-Hydroxycholesterol-25,26,26,26-27,27,27-D7
IUPAC Name: (3S,7S,8S,9S,10R,13R,14S,17R)-10,13-dimethyl-17-[(2R)-5,6,6,6-tetradeuterio-5-(trideuteriomethyl)hexan-2-yl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene-3,7-diol | CAS Registry Number: 349553-94-2

Molecular Formula: C26H44O2Molecular Weight: 395.679 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: HKTLZNPSEKWWSW-AXVNBPJJSA-N

• 17-Ethynylestriol
IUPAC Name: (8R,13S,16R,17R)-17-ethynyl-13-methyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthrene-3,16,17-triol | CAS Registry Number: 4717-40-2
Synonyms: CTK8F3210, AG-F-60763

Molecular Formula: C20H24O3Molecular Weight: 312.402760 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 3

InChIKey: VSODIPLKPBLGCC-DFCHBNGBSA-N

• (S)-4-(4-Aminobenzyl)-1,3-oxazolidin-2-one
IUPAC Name: (4S)-4-[(4-aminophenyl)methyl]-1,3-oxazolidin-2-one | CAS Registry Number: 152305-23-2
Synonyms: (S)-4-(4-Aminobenzyl)-2(1H)-oxazolidinone, (S)-4-(4-Aminobenzyl)-2-oxazolidinone, (S)-4-(4-aminobenzyl)oxazolidin-2-one, (4S)-4-[(4-Aminophenyl)methyl]-2-oxazolidinone, (S)-4-(4-AMINO-BENZYL)-OXAZOLIDINE-2-ONE, (S)-4-(4-AMINOBENZYL)-1,3-OXAZOLIDIN-2-ONE, (4S)-4-[(4-aminophenyl)methyl]-1,3-oxazolidin-2-one, (S)-4-(4-Aminobenzyl)-1,3-oxozolidin-2-one, SBB070336, AG-D-99528, (S)-4-(4'-AMINOBENZYL)-1,3-OXAZOLIDIN-2-ONE, (4s)-(4-aminobenzyl)-2-oxazolidine-2-one, 340041-89-6, PubChem7548, AC1OFFG2, SureCN825617, ZTR 5, 658405_ALDRICH, Jsp002933, CTK4C7393

Molecular Formula: C10H12N2O2Molecular Weight: 192.214480 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: WNAVSKJKDPLWBD-VIFPVBQESA-N

• (1R,2S)-2-Amino-1,2-diphenylethanol
IUPAC Name: (1R,2S)-2-amino-1,2-diphenylethanol | CAS Registry Number: 23190-16-1
Synonyms: (1R,2S)-(-)-2-Amino-1,2-diphenylethanol, (1R,2S)-2-Amino-1,2-diphenyl-ethanol, PubChem5986, AC1LEXYY, AC1Q59PK, SureCN1131702, KSC201S9N, 331899_ALDRICH, CHEMBL442934, Jsp004682, CTK1A1996, GEJJWYZZKKKSEV-UONOGXRCSA-, MolPort-001-794-198, KST-1A2944, ACN-S001453, ACN-S003457, ACT06724, ACT07644, ANW-25077, AR-1A1156

Molecular Formula: C14H15NOMolecular Weight: 213.275000 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: GEJJWYZZKKKSEV-UONOGXRCSA-N

• 2-Fluoro-2-deoxy-D-glucose
IUPAC Name: (2S,3R,4R,5S)-2-fluoro-3,4,5,6-tetrahydroxyhexanal | CAS Registry Number: 29702-43-0
Synonyms: (2S,3R,4R,5S)-2-fluoro-3,4,5,6-tetrahydroxyhexanal

Molecular Formula: C6H11FO5Molecular Weight: 182.146943 [g/mol]
H-Bond Donor: 4H-Bond Acceptor: 6

InChIKey: AOYNUTHNTBLRMT-DPYQTVNSSA-N

• (2S,5S)-(+)-Hexanediol
IUPAC Name: (2S,5S)-hexane-2,5-diol | CAS Registry Number: 34338-96-0
Synonyms: 2,5-HEXANEDIOL, (2S,5S)-2,5-Hexanediol, 396729_ALDRICH, 52793_FLUKA, ZINC00388717, 2935-44-6

Molecular Formula: C6H14O2Molecular Weight: 118.174160 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: OHMBHFSEKCCCBW-WDSKDSINSA-N

• (2-Carboxyethyl)tripheylphosphonium Chloride
IUPAC Name: 2-carboxyethyl(triphenyl)phosphanium chloride | CAS Registry Number: 36626-29-6
Synonyms: NSC165227, ST5407520

Molecular Formula: C21H20ClO2PMolecular Weight: 370.809061 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: GALLWJZTZYJVSL-UHFFFAOYSA-N

• (1S,2S,3R,6S)-6Amino-4-(hydroxymethyl)cyclohex-4-ene-1,2,3-triol hydrochloride
IUPAC Name: (1S,2S,3R,6S)-6-amino-4-(hydroxymethyl)cyclohex-4-ene-1,2,3-triol | CAS Registry Number: 38231-86-6
Synonyms: Valienamine, CID193758, 6-AMINO-4-HYDROXYMETHYL-CYCLOHEX-4-ENE-1,2,3-TRIOL, ACI, (1R,2R,3S,6R)-6-AMINO-4-(HYDROXYMETHYL)CYCLOHEX-4-ENE-1,2,3-TRIOL, 4-Cyclohexene-1,2,3-triol, 6-amino-4-(hydroxymethyl)-, (1S-(1alpha,2beta,3alpha,6alpha))-, ADH, CMN, CYL, HMC

Molecular Formula: C7H13NO4Molecular Weight: 175.182420 [g/mol]
H-Bond Donor: 5H-Bond Acceptor: 5

InChIKey: XPHOBMULWMGEBA-VZFHVOOUSA-N

• (1S)-(-)-Camphanic chloride
IUPAC Name: (1R,4S)-1,7,7-trimethyl-2-oxo-3-oxabicyclo[2.2.1]heptane-4-carbonyl chloride | CAS Registry Number: 39637-74-6
Synonyms: Camphanoylchloride, Camphanoyl chloride, Ambap5166, 226173_ALDRICH, 21287_FLUKA, (−)-Camphanoyl chloride, EINECS 254-552-4, ZINC02508200, 3-Oxa-2-oxobornane-4-carbonyl chloride, (1S)-(−)-Camphanic chloride, (1S)-3-Oxo-4,7,7-trimethyl-2-oxabicyclo[2.2.1]heptane-1-carbonyl chloride, 2-Oxabicyclo(2.2.1)heptane-1-carbonyl chloride, 4,7,7-trimethyl-3-oxo-, (1S)-

Molecular Formula: C10H13ClO3Molecular Weight: 216.661420 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: PAXWODJTHKJQDZ-VHSXEESVSA-N

• (R)-(-)-Propanediol
IUPAC Name: (2R)-propane-1,2-diol | CAS Registry Number: 4254-14-2
Synonyms: (R)-Propylene glycol, D-1,2-propanediol, (R)-1,2-Propanediol, R-1,2-PROPANEDIOL, (R)-Propane-1,2-diol, 2,3-PROPANDIOL, (2R)-propane-1,2-diol, 540242_ALDRICH, 82284_FLUKA, CHEBI:28972, CID1030, CPD-8891, NSC90793, ZINC00895318, (R)-(−)-Propylene glycol, (R)-(−)-Propylene glycerol, (R)-(−)-1,2-Propanediol, TL8003024, C02912, PGR

Molecular Formula: C3H8O2Molecular Weight: 76.094420 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: DNIAPMSPPWPWGF-GSVOUGTGSA-N

• (+)-((Camphoryl)sulfonyl)oxaziridine
Synonyms: ZINC04202596

Molecular Formula: C10H15NO3SMolecular Weight: 229.296000 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: GBBJBUGPGFNISJ-YDQXZVTASA-N

• (-)-Actinonin
IUPAC Name: (2R)-N'-hydroxy-N-[(2S)-1-[(2S)-2-(hydroxymethyl)pyrrolidin-1-yl]-3-methyl-1-oxobutan-2-yl]-2-pentylbutanediamide | CAS Registry Number: 13434-13-4
Synonyms: actinonin, Actinonine, Spectrum2_000628, Spectrum3_000680, Spectrum4_001932, Spectrum5_000728, Lopac0_000010, BSPBio_002379, KBioGR_002305, DivK1c_001024, SPBio_000596, KBio1_001024, KBio3_001599, NINDS_001024, AIDS110792, C19H35N3O5, AIDS-110792, CID443600, CPD0-1358, IDI1_001024

Molecular Formula: C19H35N3O5Molecular Weight: 385.498300 [g/mol]
H-Bond Donor: 4H-Bond Acceptor: 5

InChIKey: XJLATMLVMSFZBN-VYDXJSESSA-N

• (S)-Mephenytoin
IUPAC Name: (5S)-5-ethyl-3-methyl-5-phenylimidazolidine-2,4-dione | CAS Registry Number: 70989-04-7
Synonyms: S-Mephenytoin, Mephenytoin, D-, MEPHENYTOIN, (S)-(+)-Mephenytoin, UC175_SIGMA, CID107921, ZINC00896648, NCGC00160394-01, (S)-(+)-5-Ethyl-3-methyl-5-phenylhydantoin, (5S)-5-Ethyl-3-methyl-5-phenyl-2,4-imidazolidinedione, (S)-(+)-5-Ethyl-3-methyl-5-phenyl-2,4-imidazolidinedione, 2,4-Imidazolidinedione, 5-ethyl-3-methyl-5-phenyl-, (S)-

Molecular Formula: C12H14N2O2Molecular Weight: 218.251760 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: GMHKMTDVRCWUDX-LBPRGKRZSA-N

• 1,2,3,4-Tetra-O-Acetyl-6-Diphenylphosphoryl-Beta-D-Mannopyranose
IUPAC Name: [(3R,4S,5R,6S)-4,5,6-triacetyloxy-2-(diphenoxyphosphoryloxymethyl)oxan-3-yl] acetate | CAS Registry Number: 108321-48-8
Synonyms: 1,2,3,4-Tetra-O-acetyl-6-diphenylphosphoryl-beta-D-mannopyranose, CTK8E7088, FT-0606204

Molecular Formula: C26H29O13PMolecular Weight: 580.474422 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 13

InChIKey: IKZZNFIJWMQZMQ-NZFACQQJSA-N

• 1,3,4,6-Tetra-O-Acetyl-2-O-Trifluoromethylsulfonyl-B-D-Mannopyranose(mannose Triflate)
IUPAC Name: [3,4,6-triacetyloxy-5-(trifluoromethylsulfonyloxy)oxan-2-yl]methyl acetate | CAS Registry Number: 92051-23-5
Synonyms: MolPort-000-165-556, CID2782943, [3,4,6-triacetyloxy-5-(trifluoromethylsulfonyloxy)oxan-2-yl]methyl Acetate, 1,3,4,6-Tetra-O-acetyl-2-O-trifluoromethanesulfonyl-beta-D-mannopyranose

Molecular Formula: C15H19F3O12SMolecular Weight: 480.364370 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 15

InChIKey: OIBDVHSTOUGZTJ-UHFFFAOYSA-N

• (2E)-N-(4-Bromophenyl)-3-Ethoxy-2-Propenamide
IUPAC Name: N-(4-bromophenyl)-3-ethoxyprop-2-enamide | CAS Registry Number: 327058-51-5
Synonyms: (2E)-N-(4-BROMOPHENYL)-3-ETHOXY-2-PROPENAMIDE, SureCN3973119, CTK4G9162, CTK8I2157, AG-F-09549, 2-Propenamide,N-(4-bromophenyl)-3-ethoxy-, (2E)-, (2E)-N-(4-Bromophenyl)-3-(ethyloxy)-2-propenamide;(2E)-N-(4-Bromophenyl)-3-ethoxy-2-propenamide;(2E)-N-(4-Bromophenyl)-3-ethoxyprop-2-enamide;

Molecular Formula: C11H12BrNO2Molecular Weight: 270.122480 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: VIIWJXDWZVDVTN-UHFFFAOYSA-N

• 2-Bromobenzene-1,3,5-D3
IUPAC Name: 2-bromo-1,3,5-trideuteriobenzene | CAS Registry Number: 13122-41-3
Synonyms: 2-Bromobenzene-1,3,5-d3, Benzene-1,3,5-d3, 2-bromo-

Molecular Formula: C6H5BrMolecular Weight: 160.026385 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: QARVLSVVCXYDNA-NHPOFCFZSA-N

• 3-Hydroxy carbamazepine
IUPAC Name: 9-hydroxybenzo[b][1]benzazepine-11-carboxamide | CAS Registry Number: 68011-67-6
Synonyms: 3-Hydroxycarbamazepine, MolPort-003-847-785, CID135290, ZINC06117175, 3-Hydroxy-5H-dibenz(b,f)azepine-5-carboxamide, C16602, 5H-Dibenz(b,f)azepine-5-carboxamide, 3-hydroxy-

Molecular Formula: C15H12N2O2Molecular Weight: 252.267980 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: QQCFBZCATDIWTH-UHFFFAOYSA-N

• 2,2-Diphenylpentanoic acid
IUPAC Name: 2,2-diphenylpentanoic acid | CAS Registry Number: 841-32-7
Synonyms: Diphenylpropylacetic acid, 2,2-Diphenylvaleric acid, Valeric acid, 2,2-diphenyl-, SKF 2314, MolPort-003-846-967, CID96732, NSC88046, EINECS 212-665-6, NSC 88046, DAH1654431, Benzeneacetic acid, alpha-phenyl-alpha-propyl-, Benzeneacetic acid, .alpha.-phenyl-.alpha.-propyl-

Molecular Formula: C17H18O2Molecular Weight: 254.323620 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: IVYXLCYENQNVHM-UHFFFAOYSA-N

• 2,6-Dimethylaniline-D6
IUPAC Name: 2,6-bis(trideuteriomethyl)aniline | CAS Registry Number: 919785-81-2
Synonyms: 2,6-Dimethylaniline-d6, CTK8F3874, FT-0667311

Molecular Formula: C8H11NMolecular Weight: 127.216611 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: UFFBMTHBGFGIHF-WFGJKAKNSA-N

• (R)-5-Chloro-alpha-(cyclopropylethynyl)-2-amino-alpha-(trifluoromethyl)benzenemethanol
IUPAC Name: (2R)-2-(2-amino-5-chlorophenyl)-4-cyclopropyl-1,1,1-trifluorobut-3-yn-2-ol | CAS Registry Number: 927812-33-7
Synonyms: CTK8E9659, ZINC22054360, RL05840, FT-0664604, (R)-5-Chloro-alpha-(cyclopropylethynyl)-2-amino-alpha-(trifluoromethyl) benzenemethanol, (R)-5-CHLORO-ALPHA-(CYCLOPROPYLETHYNYL)-2-AMINO-ALPHA-(TRIFLUOROMETHYL)BENZENEMETHANOL

Molecular Formula: C13H11ClF3NOMolecular Weight: 289.680750 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 5

InChIKey: KEMUGFRERPPUHB-GFCCVEGCSA-N

• 1-Bromoheptane-D15
IUPAC Name: 1-bromo-1,1,2,2,3,3,4,4,5,5,6,6,7,7,7-pentadecadeuterioheptane | CAS Registry Number: 98195-42-7
Synonyms: 1-BROMOHEPTANE-D15

Molecular Formula: C7H15BrMolecular Weight: 194.190427 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: LSXKDWGTSHCFPP-PMELWRBQSA-N

• 5-Amino-3-(2-thienyl)pyrazole
IUPAC Name: 5-thiophen-2-yl-1H-pyrazol-3-amine | CAS Registry Number: 96799-03-0
Synonyms: 3-(2-Thienyl)-1H-pyrazol-5-amine, 3-(thiophen-2-yl)-1H-pyrazol-5-amine, 5-Thien-2-yl-1H-pyrazol-3-amine, GNF-Pf-1850, 5-(2-thienyl)-1H-pyrazol-3-amine, 5-thiophen-2-yl-1H-pyrazol-3-amine, 5-amino-3-(thien-2-yl)-1h-pyrazole, ST085506, 3-(2-thienyl)pyrazole-5-ylamine, AC1LAXWX, Maybridge1_004097, ACMC-20am19, AC1Q51ID, SureCN1143192, SureCN1665919, 586269_ALDRICH, CHEMBL600711, CTK7D5163, CTK7E0477, HMS553C07

Molecular Formula: C7H7N3SMolecular Weight: 165.215580 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: TXSOLYKLZBJHFF-UHFFFAOYSA-N

• (1s,4r)-4-amino-2-cyclopentene-1-methanol
IUPAC Name: (4-aminocyclopent-2-en-1-yl)methanol | CAS Registry Number: 136522-35-5
Synonyms: ACMC-20mw6w, 2-Cyclopentene-1-methanol,4-amino-, (1S,4R)-, SureCN2905360, CYC121, 2-Cyclopentene-1-methanol, 4-amino-, (1S,4R)-

Molecular Formula: C6H11NOMolecular Weight: 113.157640 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: UXKZFJDNFBNQHE-UHFFFAOYSA-N

• (S)-2-Bromopropionic Acid
IUPAC Name: (2S)-2-bromopropanoic acid | CAS Registry Number: 32644-15-8
Synonyms: S-2-Bromopropionic acid, (S)-(-)-2-Bromopropionic acid, (S)-2-Bromopropanoic Acid, (2S)-2-bromopropanoic acid, L-2-Bromopropionic Acid, (S)-2-bromopropionic acid, (2s)-(-)-2-Bromopropionic acid, sGPhCQbILuSRX@, PubChem8278, AC1LD4KG, L-|A-Bromopropionic Acid, (S)-|A-Bromopropionic Acid, (-)-|A-Bromopropanoic Acid, 385514_ALDRICH, CTK3J7621, MolPort-003-845-404, L-ALPHA-BROMOPROPIONIC ACID, ANW-27393, (S)-ALPHA-BROMOPROPIONIC ACID, (-)-ALPHA-BROMOPROPANOIC ACID

Molecular Formula: C3H5BrO2Molecular Weight: 152.974600 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: MONMFXREYOKQTI-REOHCLBHSA-N

• (1R,2R,5R)-(+)-2-Hydroxy-3-pinanone
IUPAC Name: (1R,4R,5R)-4-hydroxy-4,6,6-trimethylbicyclo[3.1.1]heptan-3-one | CAS Registry Number: 24047-72-1
Synonyms: (1R,2R,5R)-2-hydroxy-3-pinanone, PubChem18156, AC1O6JRR, (+)-2-Hydroxypinocamphone, SureCN1171547, (+)-2|A-Hydroxy-3-pinanone, CTK8B1279, MolPort-009-198-943, ANW-25308, ZINC00389859, AKOS015855447, (+)-2|A-Hydroxy-10|A-pinan-3-one, AK-34297, KB-00439, (+)-(1R,2R,5R)-2-Hydroxy-3-pinanone, FT-0604408, H0862, I14-10179, [1R-(1|A,2|A.,5|A)]- (+)-2-Hydroxy-3-pinanone, (1R,4R,5R)-4-hydroxy-4,6,6-trimethylbicyclo[3.1.1]heptan-3-one

Molecular Formula: C10H16O2Molecular Weight: 168.232840 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: VZRRCQOUNSHSGB-BRDIYROLSA-N

• (1S,2S)-Cyclohexane-1,2-diamine
IUPAC Name: cyclohexane-1,2-diamine | CAS Registry Number: 21436-03-3
Synonyms: 1,2-Cyclohexanediamine, 1,2-Cylohexanediamine, cis-1,2-Cyclohexanediamine, 1,2-DIAMINOCYCLOHEXANE, cis-1,2-Cyclohexandiamine, Cyclohex-1,2-ylenediamine, trans-1,2-Cyclohexanediamine, cyclohexane-1,2-diamine, trans-1,2-Cyclohexaneiamine, HSDB 5748, 132551_ALDRICH, 293962_ALDRICH, (+)-S,S-1,2-Diaminocyclohexane, EINECS 211-776-7, CID4610, (1S,2S)-(+)-1,2-Diaminocyclohexane, (-)-R,R-1,2-Diaminocyclohexane, BRN 0506142, NSC362640, NSC362641

Molecular Formula: C6H14N2Molecular Weight: 114.188760 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: SSJXIUAHEKJCMH-UHFFFAOYSA-N

• (S)-(+)-1-Phenyl-1,2-ethanediol
IUPAC Name: (1S)-1-phenylethane-1,2-diol | CAS Registry Number: 25779-13-9
Synonyms: (S)-(+)-1-Phenylethane-1,2-diol, (S)-1-Phenylethane-1,2-diol, (1S)-1-phenylethane-1,2-diol, (S)-1-phenyl-1,2-ethanediol, (S)-(-)-1-Phenyl-1,2-ethanediol, AG-E-79635, ST51037659, (-)-Styrene glycol, (R)-(-)-Phenylethylene glycol, (+)-Styrene glycol, PubChem7148, (S)-(+)-Styreneglycol, (S)-(+)-Styrene glycol, AC1LD6Y2, SureCN1947849, KSC201S3B, 302155_ALDRICH, Jsp005095, (S)-(+)-Phenylethylene glycol, CTK1A1930

Molecular Formula: C8H10O2Molecular Weight: 138.163800 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: PWMWNFMRSKOCEY-MRVPVSSYSA-N

• 1,4-Dithiothreithol
IUPAC Name: (2S,3S)-1,4-bis(sulfanyl)butane-2,3-diol | CAS Registry Number: 27565-41-9
Synonyms: Dithiothreitol, Sputolysin, dl-Dithiothreitol, Cleland's reagent, rac-Dithiothreitol, 1,4-Dithiothreitol, D-Dtt, Reagents, Cleland's, D-1,4-Dithiothreitol, (+/-)-Dithiothreitol, nchembio.121-comp22, DL-1,4-Dithiothreitol, 1,4-Dithio-dl-threitol, DL-Dithiothreitol solution, DTT (threitol derivative), D9163_SIGMA, D9779_SIGMA, D0632_SIAL, D5545_SIAL, 43815_FLUKA

Molecular Formula: C4H10O2S2Molecular Weight: 154.251000 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: VHJLVAABSRFDPM-QWWZWVQMSA-N

• (S)-2-Chloropropionic acid
IUPAC Name: (2S)-2-chloropropanoic acid | CAS Registry Number: 29617-66-1
Synonyms: (2S)-Chloropropanoic acid, L-2-Chloropropanoic acid, L-2-Chloropropionic acid, alpha-L-Chloropropionic acid, (S)-2-Chloropropanoic acid, 2S-chloropropanoic acid, 2(S)-Chloropropionic acid, beta-Chloropropionic acid, 2(S)-Chloropropionic ac, Propanoic acid, 2-chloro-, L-alpha-Chloropropionic acid, (-)-2-Chloropropanoic acid, (-)-2-Chloropropionic acid, 2-CHLOROPROPANOIC ACID, Propanoic acid, 2-chloro-, (S)-, Propionic acid, 2-chloro-, L-, 306797_ALDRICH, LMFA01090032, Propionic acid, 2-chloro-, L- (8CI), SB 01780

Molecular Formula: C3H5ClO2Molecular Weight: 108.523600 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: GAWAYYRQGQZKCR-REOHCLBHSA-N


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