| SpectraBase Spectrum ID |
CiZQ6YxWj9w |
| Name |
Methyl 3.beta.-Hydroxy-24-nor-9,10-secochol-5,7,10(19)-trien-23-oate |
| Alternate Name(s) |
Methyl (3R)-3-[(1R,3aS,4E,7aR)-4-{2-[(1E,5S)-5-hydroxy-2-methylidenecyclohexylidene]ethylidene}-7a-methyl-octahydro-1H-inden-1-yl]butanoate |
| CAS Registry Number |
75716-76-6 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C24H36O3 |
| InChI |
InChI=1S/C24H36O3/c1-16-7-10-20(25)15-19(16)9-8-18-6-5-13-24(3)21(11-12-22(18)24)17(2)14-23(26)27-4/h8-9,17,20-22,25H,1,5-7,10-15H2,2-4H3/b18-8+,19-9+/t17-,20+,21-,22+,24-/m1/s1 |
| InChIKey |
REKOVYVAHDVLKH-PYSQNYEOSA-N |
| Molecular Weight |
372.549 g/mol |
| SMILES |
O[C@@]1(C\C(=C/C=C/2[C@]3([C@@]([C@](CC3)([C@@](CC(=O)OC)(C)[H])[H])(CCC2)C)[H])C(CC1)=C)[H] |
| SPLASH |
splash10-01bi-0903000000-56356fbaa5b8cac2eb10 |
| Source of Spectrum |
J-46-457-0 |
| Wiley ID |
1355822 |
