Ergost-7-en-6-one, 3,5,9-trihydroxy-, (3β,5α)-
CAS Registry Number®
211486-13-4
CAS Name
Ergost-7-en-6-one, 3,5,9-trihydroxy-, (3β,5α)-Molecular Formula
C28H46O4Molecular Mass
446.66Cite this Page
Ergost-7-en-6-one, 3,5,9-trihydroxy-, (3β,5α)-. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=211486-13-4 (retrieved ) (CAS RN: 211486-13-4). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Other Names and Identifiers
InChI
InChI=1S/C28H46O4/c1-17(2)18(3)7-8-19(4)21-9-10-22-23-15-24(30)28(32)16-20(29)11-12-26(28,6)27(23,31)14-13-25(21,22)5/h15,17-22,29,31-32H,7-14,16H2,1-6H3/t18-,19+,20-,21+,22-,25+,26+,27+,28-/m0/s1
InChIKey
InChIKey=WNCDXWLLIJDSNA-ZFZPKPCHSA-N
SMILES
O[C@@]12C([C@]3([C@](C)(CC1)[C@@]([C@@H](CC[C@@H](C(C)C)C)C)(CC3)[H])[H])=CC(=O)[C@]4(O)[C@]2(C)CC[C@H](O)C4
Canonical SMILES
O=C1C=C2C3CCC(C(C)CCC(C)C(C)C)C3(C)CCC2(O)C4(C)CCC(O)CC14O
Other Names for this Substance
- Ergost-7-en-6-one, 3,5,9-trihydroxy-, (3β,5α)-
- (24S)-3β,5α,9α-Trihydroxyergost-7-en-6-one
- (22E)-3β,5α,9α-Trihydroxyergost-7-en-6-one