| SpectraBase Spectrum ID |
FnHgunVtm8k |
| Name |
4,5-Secocholest-8-ene-3,5-dione, 14-methyl- |
| Alternate Name(s) |
(3R,3aR,6R,9bR)-3-[(1R)-1,5-dimethylhexyl]-3a,6,9b-trimethyl-6-(3-oxobutyl)-1,2,3,3a,4,5,6,8,9,9b-decahydro-7H-cyclopenta[a]naphthalen-7-one
14.alpha.-methyl-4,5-seco-cholest-8-en-3,5-dione
14.alpha.-methyl-4,5-seco-cholest-8-ene-3,5-dione |
| CAS Registry Number |
58545-16-7 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C28H46O2 |
| InChI |
InChI=1S/C28H46O2/c1-19(2)9-8-10-20(3)22-14-17-28(7)24-11-12-25(30)26(5,16-13-21(4)29)23(24)15-18-27(22,28)6/h19-20,22H,8-18H2,1-7H3/t20-,22-,26-,27-,28+/m1/s1 |
| InChIKey |
TTZSHUCWGPXAQK-BLXCDPOOSA-N |
| Molecular Weight |
414.674 g/mol |
| SMILES |
[C@@]12(C3=C([C@](CCC(=O)C)(C)C(CC3)=O)CC[C@@]1([C@@]([C@@](CCCC(C)C)(C)[H])(CC2)[H])C)C |
| SPLASH |
splash10-0006-0009200000-cbf03ca9f6d4788f67cf |
| Source of Spectrum |
B-28-2665-0 |
| Wiley ID |
1375739 |
