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Cholic Acid Impurity 81

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Cholic Acid Impurity 81

Impurity

CAS Number

2024612-47-1

Molecular Formula

C28H36O2

Product format

Neat

Molecular Weight

404.59

API Family

Cholic Acid

Synonyms

2024612-47-1; (3R, 5R, 8S, 10S, 13S, 14S, Z)-17-ETHYLIDENE-10, 13-DIMETHYL-2, 3, 4, 5, 6, 7, 8, 10, 12, 13, 14, 15, 16, 17-TETRADECAHYDRO-1H-CYCLOPENTA[A]PHENANTHREN-3-YL BENZOATE; SCHEMBL20088684; EX-A6083; H60429; Pregna-9(11), 17(20)-dien-3-ol, 3-benzoate, (3|A, 5|A and 17Z)-

Iupac Name

[(3R, 5R, 8S, 10S, 13S, 14S, 17Z)-17-ethylidene-10, 13-dimethyl-1, 2, 3, 4, 5, 6, 7, 8, 12, 14, 15 and 16-dodecahydrocyclopenta[a]phenanthren-3-yl] benzoate

InChI

InChI=1S/C28H36O2/c1-4-20-11-13-24-23-12-10-21-18-22(30-26(29)19-8-6-5-7-9-19)14-16-28(21,3)25(23)15-17-27(20,24)2/h4-9,15,21-24H,10-14,16-18H2,1-3H3/b20-4-/t21-,22-,23+,24+,27-,28+/m1/s1

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