| SpectraBase Spectrum ID |
8DGxBZDJ8Dc |
| Name |
5.alpha.,6.alpha.-Epoxy-5.alpha.-ergosta-8(14),22E-diene-3.beta.,7.alpha.-diol |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C28H44O3 |
| InChI |
InChI=1S/C28H44O3/c1-16(2)17(3)7-8-18(4)20-9-10-21-23-22(12-13-26(20,21)5)27(6)14-11-19(29)15-28(27)25(31-28)24(23)30/h7-8,16-20,22,24-25,29-30H,9-15H2,1-6H3/b8-7+/t17-,18+,19-,20+,22-,24-,25-,26+,27+,28-/m0/s1 |
| InChIKey |
MEIJIKXWOMTKCH-SDNRFBISSA-N |
| Molecular Weight |
428.657 g/mol |
| SMILES |
O[C@@]1([C@]2([C@]3(C[C@](CC[C@@]3([C@@]3(C1=C1CC[C@@]([C@]1(CC3)C)([C@@](\C=C\[C@@](C(C)C)(C)[H])(C)[H])[H])[H])C)(O)[H])O2)[H])[H] |
| SPLASH |
splash10-02t9-9058800000-d8ed31599420f73ec48e |
| Source of Spectrum |
QA-42-99-1 |
| Synonyms |
(3S,4aR,5aS,6S,9R,9aR,11aS,11bR)-9a,11b-dimethyl-9-[(1R,2E,4R)-1,4,5-trimethyl-2-hexenyl]-1,2,3,4,5a,6,7,8,9,9a,10,11,11a,11b-tetradecahydrocyclopenta[1,2]phenanthro[8a,9-b]oxirene-3,6-diol |
| Wiley ID |
862032 |
