| SpectraBase Spectrum ID |
3UTsxgz2erc |
| Name |
Ergosta-1,4-dien-3-one, 24,25-epoxy-7,22-dihydroxy-, (7.alpha.,22R,24S)- |
| CAS Registry Number |
114176-01-1 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C28H42O4 |
| InChI |
InChI=1S/C28H42O4/c1-16(23(31)15-28(6)25(2,3)32-28)19-7-8-20-24-21(10-12-27(19,20)5)26(4)11-9-18(29)13-17(26)14-22(24)30/h9,11,13,16,19-24,30-31H,7-8,10,12,14-15H2,1-6H3/t16-,19+,20-,21-,22+,23+,24-,26-,27+,28-/m0/s1 |
| InChIKey |
RPCWUNDQUXNHLA-DOBNTRQBSA-N |
| Molecular Weight |
442.640 g/mol |
| SMILES |
O[C@]1([C@]2([C@]3([C@@]([C@@]([C@@]([C@@](C[C@@]4(OC4(C)C)C)(O)[H])(C)[H])(CC3)[H])(CC[C@@]2([C@@]2(C(C1)=CC(C=C2)=O)C)[H])C)[H])[H])[H] |
| SPLASH |
splash10-002f-0000900000-43e0c974f0e6b6be726b |
| Source of Spectrum |
KC-1988-716-8 |
| Synonyms |
(+)-Petuniasterone C
(1S,2R,9R,10S,11S,14R,15R)-9-hydroxy-14-[(2S,3R)-3-hydroxy-4-[(2S)-2,3,3-trimethyloxiran-2-yl]butan-2-yl]-2,15-dimethyltetracyclo[8.7.0.0(2,7).0(11,15)]heptadeca-3,6-dien-5-one
(22R,24S)-24,25-epoxy-7.alpha.,22-dihydroxyergosta-1,4-dien-3-one
Petuniasterone C |
| Wiley ID |
1385481 |
