| SpectraBase Spectrum ID |
1o6yP70QbJk |
| Name |
(22E,24R)-7-.alpha.-Hydroxy-5.alpha.-ergost-2,22-dien-6-one |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C28H44O2 |
| InChI |
InChI=1S/C28H44O2/c1-17(2)18(3)10-11-19(4)20-12-13-21-24-22(14-16-28(20,21)6)27(5)15-8-7-9-23(27)25(29)26(24)30/h7-8,10-11,17-24,26,30H,9,12-16H2,1-6H3/b11-10+/t18-,19+,20+,21-,22-,23+,24-,26-,27+,28+/m0/s1 |
| InChIKey |
SIQLCUPCNGYGKI-MLFIFIPPSA-N |
| Molecular Weight |
412.658 g/mol |
| SMILES |
O[C@@]1(C([C@]2(CC=CC[C@@]2([C@@]2([C@@]1([C@@]1(CC[C@]([C@@](\C=C\[C@](C)(C(C)C)[H])(C)[H])([C@@]1(C)CC2)[H])[H])[H])[H])C)[H])=O)[H] |
| SPLASH |
splash10-0002-0009000000-e12ce2c11ae9218fffd2 |
| Source of Spectrum |
SO-0-427-12 |
| Synonyms |
(5alpha,7alpha,22E)-7-hydroxyergosta-2,22-dien-6-one |
| Wiley ID |
1540605 |
