Chola-20(22),23-diene-3,12-diol,24,24-diphenyl-,3,12-diacetate,(3a,5b,12a)-

CAS

82426-77-5

Catalog Number

ACM82426775

Category

Other Products

Molecular Weight

594.8226

Molecular Formula

C₄₀H₅₀O₄

MSDS COA Spec Sheet

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Specification

Synonyms

CTK5E9665, 82426-77-5, AG-K-62878, Chola-20(22),23-diene-3,12-diol,24,24-diphenyl-, 3,12-diacetate, (3a,5b,12a)-, Chola-20(22),23-diene-3,12-diol,24,24-diphenyl-, diacetate, (3a,5b,12a)- (9CI); NSC 126812

IUPAC Name

[(8R,9S,10S,13S,14S,17R)-12-acetyloxy-17-(5,5-diphenylpenta-2,4-dien-2-yl)-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-yl] acetate

Canonical SMILES

CC(=CC=C(C1=CC=CC=C1)C2=CC=CC=C2)C3CCC4C3(C(CC5C4CCC6C5(CCC(C6)OC(=O)C)C)OC(=O)C)C

InChI Key

MXSSSAFMPHSRQJ-HBTZVTOTSA-N

Boiling Point

657.5ºC at 760mmHg

Flash Point

321.2ºC

Density

1.13g/cm³

Exact Mass

594.37100