| SpectraBase Spectrum ID |
9blu1sokyTz |
| Name |
3.beta.,6.alpha.-Dihydroxy-9-oxo-9,11-seco-5.alpha.-cholest-7-en-11-al |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C27H44O4 |
| InChI |
InChI=1S/C27H44O4/c1-17(2)7-6-8-18(3)21-9-10-22(26(21,4)13-14-28)20-16-24(30)23-15-19(29)11-12-27(23,5)25(20)31/h14,16-19,21-24,29-30H,6-13,15H2,1-5H3/t18-,19+,21-,22?,23-,24+,26-,27+/m1/s1 |
| InChIKey |
SLOAHJCLDHOLST-DANROJOLSA-N |
| Molecular Weight |
432.645 g/mol |
| SMILES |
O[C@@]1([C@]2(C[C@](CC[C@@]2(C(C(=C1)C1[C@@]([C@@]([C@@](CCCC(C)C)(C)[H])(CC1)[H])(CC=O)C)=O)C)(O)[H])[H])[H] |
| SPLASH |
splash10-000i-0109200000-19b55bfb23e2b977eacf |
| Source of Spectrum |
F-47-7945-1 |
| Synonyms |
{(1R,5R)-2-[(4S,4aS,6S,8aS)-4,6-dihydroxy-8a-methyl-1-oxo-1,4,4a,5,6,7,8,8a-octahydro-2-naphthalenyl]-5-[(1R)-1,5-dimethylhexyl]-1-methylcyclopentyl}acetaldehyde |
| Wiley ID |
1382469 |
