Products 1516887-33-4

CAS 1516887-33-4 appears in our catalog under these names: (3±,5²,E)-6-Ethylidene-3-hydroxy-7-oxocholan-24-oic Acid, (R)-4-((3R，5R，8S，9S，10R，13R，14S，17R，E)-6-Ethylidene-3-hydroxy-10，13-dimethyl-7-oxohexadecahydro-1H-cyclopenta[a]phenanthren-17-yl)pentanoic acid, 99%, (R)-4-((3R,5R,8S,9S,10R,13R,14S,17R,E)-6-Ethylidene-3-hydroxy-10,13-dimethyl-7-oxohexadecahydro-1H-cyclopenta[a]phenanthren-17-yl)pentanoic acid, 99%. Offered by: Biosynth, Chemat, Fluorochem. Available pack sizes: 5000mg, 10000mg, 250mg, 1g.

(3±,5²,E)-6-Ethylidene-3-hydroxy-7-oxocholan-24-oic Acid
Biosynth
  • size: 5000mg, 10000mg
  • Variants: 2
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(R)-4-((3R，5R，8S，9S，10R，13R，14S，17R，E)-6-Ethylidene-3-hydroxy-10，13-dimethyl-7-oxohexadecahydro-1H-cyclopenta[a]phenanthren-17-yl)pentanoic acid, 99%
Chemat
  • size: 250mg
  • Variants: 1
from 170.00
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(R)-4-((3R,5R,8S,9S,10R,13R,14S,17R,E)-6-Ethylidene-3-hydroxy-10,13-dimethyl-7-oxohexadecahydro-1H-cyclopenta[a]phenanthren-17-yl)pentanoic acid, 99%
Fluorochem
  • size: 1g
  • Variants: 1
from 638.33
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Structural formula: {0} (CAS {1})

(4R)-4-[(3R,5R,6E,8S,9S,10R,13R,14S,17R)-6-ethylidene-3-hydroxy-10,13-dimethyl-7-oxo-2,3,4,5,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoic acid (CAS 1516887-33-4) is a chemical compound with the molecular formula C26H40O4 and a molecular weight of 416.6 g/mol. IUPAC name: (4R)-4-[(3R,5R,6E,8S,9S,10R,13R,14S,17R)-6-ethylidene-3-hydroxy-10,13-dimethyl-7-oxo-2,3,4,5,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoic acid. InChIKey: RDCBMNFSJFALPG-VRYJCBLKSA-N.

Identity
Molecular formulaC26H40O4
Molecular weight416.6 g/mol
IUPAC name(4R)-4-[(3R,5R,6E,8S,9S,10R,13R,14S,17R)-6-ethylidene-3-hydroxy-10,13-dimethyl-7-oxo-2,3,4,5,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoic acid
InChIKeyRDCBMNFSJFALPG-VRYJCBLKSA-N
SMILESC/C=C/1\[C@@H]2C[C@@H](CC[C@@]2([C@H]3CC[C@]4([C@H]([C@@H]3C1=O)CC[C@@H]4[C@H](C)CCC(=O)O)C)C)O

Computed by PubChem (NCBI)

Synonyms: (E)-3alpha-hydroxy-6-ethylidene-7-keto-5beta-cholan-24-oic acid, Obeticholic Acid Impurity 25, RDCBMNFSJFALPG-VRYJCBLKSA-N, E-3alpha-hydroxy-6-ethylidene-7-keto-5beta-cholan-24-oic acid
Related forms of this compound
(4R)-4-[(3R,5R,6Z,8S,9S,10R,13R,14S,17R)-6-ethylidene-3-hydroxy-10,13-dimethyl-7-oxo-2,3,4,5,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoic acid C26H40O4
Isomers (same molecular formula)
(4R)-4-[(3R,5S,8S,9S,10R,13R,14S,17R)-6-ethenyl-3-hydroxy-10,13-dimethyl-7-oxo-1,2,3,4,5,6,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl]pentanoic acid C26H40O4
[(3S,8R,9S,10R,13S,14S,17S)-10,13,17-trimethyl-17-propanoyloxy-1,2,3,4,7,8,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-3-yl] propanoate C26H40O4
(4R)-4-[(5S,6R,8S,9S,10S,13R,14S,17R)-6-ethyl-10,13-dimethyl-3,7-dioxo-2,4,5,6,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoic acid C26H40O4
4-(3-acetyloxy-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl)pentanoic acid C26H40O4