Products 338976-76-4

CAS 338976-76-4 appears in our catalog under these names: 3Alpha,7Alpha-Dihydroxycoprostanic Acid-d3, >95% (HPLC), 3α,7α–Dihydroxycoprostanic acid–d3, 3α,7α-Dihydroxycoprostanic acid-d3, 99.0%. Offered by: TRC, GLPBio, MedChemExpress. Available pack sizes: 0,5mg, 2,5mg, 5mg, 500μg, 500 μg.

3Alpha,7Alpha-Dihydroxycoprostanic Acid-d3, >95% (HPLC)
TRC
  • size: 0,5mg, 2,5mg, 5mg
  • Variants: 3
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3α,7α–Dihydroxycoprostanic acid–d3
GLPBio
  • size: 500μg
  • Variants: 1
from 2773.47
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3α,7α-Dihydroxycoprostanic acid-d3, 99.0%
MedChemExpress
  • size: 500 μg
  • Variants: 1
from 2808.88
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Structural formula: {0} (CAS {1})

(6R)-6-[(3R,5S,7R,8R,9S,10S,13R,14S,17R)-3,7-dihydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]-2-(trideuteriomethyl)heptanoic acid (CAS 338976-76-4) is a chemical compound with the molecular formula C27H46O4 and a molecular weight of 437.7 g/mol. IUPAC name: (6R)-6-[(3R,5S,7R,8R,9S,10S,13R,14S,17R)-3,7-dihydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]-2-(trideuteriomethyl)heptanoic acid. InChIKey: ITZYGDKGRKKBSN-WNOXKDKUSA-N.

Identity
Molecular formulaC27H46O4
Molecular weight437.7 g/mol
IUPAC name(6R)-6-[(3R,5S,7R,8R,9S,10S,13R,14S,17R)-3,7-dihydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]-2-(trideuteriomethyl)heptanoic acid
InChIKeyITZYGDKGRKKBSN-WNOXKDKUSA-N
SMILES[2H]C([2H])([2H])C(CCC[C@@H](C)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2[C@@H](C[C@H]4[C@@]3(CC[C@H](C4)O)C)O)C)C(=O)O

Computed by PubChem (NCBI)

Synonyms: 3Alpha,7Alpha-Dihydroxycoprostanic Acid-d3, 3|A,7|A-Dihydroxycoprostanic acid-d3, 3a,7a-Dihydroxycoprostanic Acid-d3, 3alpha,7alpha-DihydroxycoprostanicAcid-d3
Related forms of this compound
(2R,6R)-6-[(3R,5S,7R,8R,9S,10S,13R,14S,17R)-3,7-dihydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]-2-methylheptanoic acid C27H46O4
(6R)-6-[(3R,5S,7R,8R,9S,10S,13R,14S,17R)-3,7-dihydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]-2-methylheptanoic acid C27H46O4
(2S,6R)-6-[(3R,5S,7R,8R,9S,10S,13R,14S,17R)-3,7-dihydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]-2-methylheptanoic acid C27H46O4
Isomers (same molecular formula)
trans-(1R,3S,5Z)-5-[(2E)-2-[(1R,3aS,7aR)-1-[(2R,5R)-5-hydroxy-6-methylheptan-2-yl]-7a-methyl-2,3,3a,5,6,7-hexahydro-1H-inden-4-ylidene]ethylidene]-4-methylidenecyclohexane-1,3-diol;hydrate C27H46O4
methyl (4R)-4-[(3R,5S,6R,7R,8S,9S,10S,13R,14S,17R)-6-ethyl-3,7-dihydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoate C27H46O4
(3S,5S,8S,9S,10R,13S,14S,17R)-17-[(2S,3R,4R)-3,4-dihydroxy-6-methylheptan-2-yl]-3-hydroxy-10,13-dimethyl-1,2,3,4,5,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-6-one C27H46O4