| SpectraBase Spectrum ID |
3Zv4xbMWKnh |
| Name |
3-Acetoxy-9,10-seeochloestra-5,7,10(19)-triene |
| Alternate Name(s) |
(3S,5Z,7E)-9,10-secocholesta-5,7,10-trien-3-yl acetate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C29H46O2 |
| InChI |
InChI=1S/C29H46O2/c1-20(2)9-7-10-22(4)27-16-17-28-24(11-8-18-29(27,28)6)13-14-25-19-26(31-23(5)30)15-12-21(25)3/h13-14,20,22,26-28H,3,7-12,15-19H2,1-2,4-6H3/b24-13+,25-14-/t22-,26+,27-,28+,29-/m1/s1 |
| InChIKey |
FOXJLKMOTPKZBM-QHPBJRBLSA-N |
| Molecular Weight |
426.685 g/mol |
| SMILES |
[C@]12([C@](\C(=C\C=C/3C(CC[C@](OC(=O)C)(C3)[H])=C)CCC1)(CC[C@@]2([C@@](CCCC(C)C)(C)[H])[H])[H])C |
| SPLASH |
splash10-05mn-2911000000-51c2029e43a6cabf804f |
| Source of Spectrum |
CJ-1992-0-0 |
| Wiley ID |
1380151 |
