(3β,5α,6β,22E)-5,9-Epidioxyergosta-7,22-diene-3,6-diol
CAS Registry Number®
348611-57-4
CAS Name
(3β,5α,6β,22E)-5,9-Epidioxyergosta-7,22-diene-3,6-diolMolecular Formula
C28H44O4Molecular Mass
444.65Cite this Page
(3β,5α,6β,22E)-5,9-Epidioxyergosta-7,22-diene-3,6-diol. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=348611-57-4 (retrieved ) (CAS RN: 348611-57-4). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Other Names and Identifiers
InChI
InChI=1S/C28H44O4/c1-17(2)18(3)7-8-19(4)21-9-10-22-23-15-24(30)28-16-20(29)11-12-26(28,6)27(23,31-32-28)14-13-25(21,22)5/h7-8,15,17-22,24,29-30H,9-14,16H2,1-6H3/b8-7+/t18-,19+,20-,21+,22-,24+,25+,26+,27+,28?/m0/s1
InChIKey
InChIKey=XCRHWCBOUDKLGM-HISZBQDUSA-N
SMILES
C[C@@]12[C@]34C([C@]5([C@](C)(CC3)[C@@]([C@@H](/C=C/[C@@H](C(C)C)C)C)(CC5)[H])[H])=C[C@@H](O)[C@]1(OO4)C[C@@H](O)CC2
Canonical SMILES
OC1C=C2C3CCC(C(C=CC(C)C(C)C)C)C3(C)CCC42OOC51CC(O)CCC45C
Other Names for this Substance
- Ergosta-7,22-diene-3,6-diol, 5,9-epidioxy-, (3β,5α,6β,22E)-
- (3β,5α,6β,22E)-5,9-Epidioxyergosta-7,22-diene-3,6-diol
- 5α,9α-Epidioxy-(22E)-ergosta-7,22-diene-3β,6β-diol