| SpectraBase Spectrum ID |
FhahHwukHSU |
| Name |
2.alpha.,10.alpha.-Epidioxy-5,10-secocholest-3-en-5-one |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C27H44O3 |
| InChI |
InChI=1S/C27H44O3/c1-18(2)7-6-8-19(3)23-13-14-24-22-12-10-20(28)9-11-21-17-27(5,30-29-21)25(22)15-16-26(23,24)4/h9,11,18-19,21-25H,6-8,10,12-17H2,1-5H3/b11-9-/t19-,21+,22+,23-,24+,25+,26-,27-/m1/s1 |
| InChIKey |
VIFSGDMQJMLYLA-DKKCJLBHSA-N |
| Molecular Weight |
416.646 g/mol |
| SMILES |
[C@@]12([C@]([C@@]3(CCC(\C=C/[C@]4(C[C@]([C@]3(CC2)[H])(OO4)C)[H])=O)[H])(CC[C@@]1([C@@](CCCC(C)C)(C)[H])[H])[H])C |
| SPLASH |
splash10-0udj-0004900000-6acc8921252c2b9cc6d1 |
| Source of Spectrum |
J-59-4399-23 |
| Synonyms |
(1R,2S,5R,6R,9S,10S,16R)-6-[(1R)-1,5-dimethylhexyl]-1,5-dimethyl-17,18-dioxatetracyclo[14.2.1.0(2,10).0(5,9)]nonadec-14-en-13-one |
| Wiley ID |
1376631 |
