| SpectraBase Spectrum ID |
2ZC6dOq8V6M |
| Name |
Cholesta-7,22-dien-24-one, 3-(acetyloxy)-4-methyl-, (3.beta.,4.alpha.,5.alpha.,22E)- |
| Alternate Name(s) |
(3beta,4alpha,5alpha,22Z)-4-methyl-24-oxocholesta-7,22-dien-3-yl acetate
3.beta.-acetoxy-4.alpha.-methyl-5.alpha.-cholesta-7,22-dien-24-one |
| CAS Registry Number |
63109-21-7 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C30H46O3 |
| InChI |
InChI=1S/C30H46O3/c1-18(2)27(32)13-8-19(3)23-11-12-25-22-9-10-24-20(4)28(33-21(5)31)15-17-30(24,7)26(22)14-16-29(23,25)6/h8-9,13,18-20,23-26,28H,10-12,14-17H2,1-7H3/b13-8-/t19-,20+,23-,24+,25+,26+,28+,29-,30+/m1/s1 |
| InChIKey |
VWVKZZMPPCCEJE-ZBIMTOPTSA-N |
| Molecular Weight |
454.695 g/mol |
| SMILES |
C1=2[C@@]([C@]3(CC[C@@]([C@]([C@@]3(CC2)[H])(C)[H])(OC(=O)C)[H])C)(CC[C@]2([C@]1(CC[C@@]2([C@@](\C=C/C(=O)C(C)C)(C)[H])[H])[H])C)[H] |
| SPLASH |
splash10-0fvi-0059700000-2a9683d2f4159a97a3a8 |
| Source of Spectrum |
K-110-1529-0 |
| Wiley ID |
1388894 |
