| SpectraBase Spectrum ID |
OwT15rIJgA |
| Name |
(8S,9S,10R,13R,14S,17R)-10,13-dimethyl-17-[(2R)-6-methyl-6-oxidanyl-heptan-2-yl]-8,9,11,12,14,15,16,17-octahydrocyclopenta[a]phenanthren-3-one |
| Alternate Name(s) |
(8S,9S,10R,13R,14S,17R)-17-[(1R)-5-hydroxy-1,5-dimethyl-hexyl]-10,13-dimethyl-8,9,11,12,14,15,16,17-octahydrocyclopenta[a]phenanthren-3-one
(8S,9S,10R,13R,14S,17R)-17-[(2R)-6-hydroxy-6-methylheptan-2-yl]-10,13-dimethyl-8,9,11,12,14,15,16,17-octahydrocyclopenta[a]phenanthren-3-one
25-hydroxycholesta-1,4,6-trien-3-one |
| CAS Registry Number |
51297-13-3 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C27H40O2 |
| InChI |
InChI=1S/C27H40O2/c1-18(7-6-14-25(2,3)29)22-10-11-23-21-9-8-19-17-20(28)12-15-26(19,4)24(21)13-16-27(22,23)5/h8-9,12,15,17-18,21-24,29H,6-7,10-11,13-14,16H2,1-5H3/t18-,21+,22-,23+,24+,26+,27-/m1/s1 |
| InChIKey |
HIRJUBYXEOKIMY-REEZCCHISA-N |
| Molecular Weight |
396.615 g/mol |
| SMILES |
OC(CCC[C@]([C@@]1([C@]2(CC[C@]3([C@]([C@@]2(CC1)[H])(C=CC=1[C@@]3(C=CC(=O)C1)C)[H])[H])C)[H])(C)[H])(C)C |
| SPLASH |
splash10-00or-9077000000-44f9e88aacb50a75b0bf |
| Source of Spectrum |
H-64-1880-0 |
| Wiley ID |
1367754 |
![(8S,9S,10R,13R,14S,17R)-10,13-dimethyl-17-[(2R)-6-methyl-6-oxidanyl-heptan-2-yl]-8,9,11,12,14,15,16,17-octahydrocyclopenta[a]phenanthren-3-one](/api/spectrum/OwT15rIJgA/structure.png?h=300&w=458 "(8S,9S,10R,13R,14S,17R)-10,13-dimethyl-17-[(2R)-6-methyl-6-oxidanyl-heptan-2-yl]-8,9,11,12,14,15,16,17-octahydrocyclopenta[a]phenanthren-3-one")
