| SpectraBase Spectrum ID |
5ceAd5QfaOU |
| Name |
Ethyl (24E)-3b-hydroxycholesta-5,24-dien-26-oate |
| Alternate Name(s) |
(R,E)-ethyl 6-((3S,8S,9S,10R,13R,14S,17R)-3-hydroxy-10,13-dimethyl-2,3,4,7,8,9,10,11,12,13,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl)-2-methylhept-2-enoate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C29H46O3 |
| InChI |
InChI=1S/C29H46O3/c1-6-32-27(31)20(3)9-7-8-19(2)24-12-13-25-23-11-10-21-18-22(30)14-16-28(21,4)26(23)15-17-29(24,25)5/h9-10,19,22-26,30H,6-8,11-18H2,1-5H3/b20-9+/t19-,22+,23+,24-,25+,26+,28+,29-/m1/s1 |
| InChIKey |
DNSANGNVKNRYKQ-FWYQQPAASA-N |
| Literature Reference DOI |
10.1016/j.bmc.2013.07.015 |
| Molecular Weight |
442.684 g/mol |
| SMILES |
O[C@]1(CC[C@@]2(C)C(C1)=CC[C@@]1([C@@]2(CC[C@@]2([C@](CC[C@@]12[H])([C@@](CC\C=C/(C)C(OCC)=O)(C)[H])[H])C)[H])[H])[H] |
| SPLASH |
splash10-0kmj-1490100000-af9fe472e4d84e60161e |
| Source of Spectrum |
G2-21-5797-9 |
| Wiley ID |
1754151 |
