| SpectraBase Spectrum ID |
2obYwJyZe0K |
| Name |
(3S,5R,6S,8S,9S,10R,13R,14S,17R)-17-[(1R)-1,5-dimethylhexyl]-3-methoxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-6-ol |
| Alternate Name(s) |
(3S,5R,6S,8S,9S,10R,13R,14S,17R)-3-methoxy-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-6-ol |
| CAS Registry Number |
85249-16-7 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C28H50O2 |
| InChI |
InChI=1S/C28H50O2/c1-18(2)8-7-9-19(3)22-10-11-23-21-17-26(29)25-16-20(30-6)12-14-28(25,5)24(21)13-15-27(22,23)4/h18-26,29H,7-17H2,1-6H3/t19-,20+,21+,22-,23+,24+,25+,26+,27-,28-/m1/s1 |
| InChIKey |
VQMARVNGIWQPSL-YDURWMTGSA-N |
| Molecular Weight |
418.706 g/mol |
| SMILES |
O[C@]1(C[C@@]2([C@@]([C@@]3([C@]1(C[C@](CC3)(OC)[H])[H])C)(CC[C@@]1([C@@]([C@@](CCCC(C)C)(C)[H])(CC[C@@]21[H])[H])C)[H])[H])[H] |
| SPLASH |
splash10-0f6t-9141600000-4ace4e1726c5e7190dc5 |
| Source of Spectrum |
H-65-2707-0 |
| Wiley ID |
1377486 |
![(3S,5R,6S,8S,9S,10R,13R,14S,17R)-17-[(1R)-1,5-dimethylhexyl]-3-methoxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-6-ol](/api/spectrum/2obYwJyZe0K/structure.png?h=300&w=458 "(3S,5R,6S,8S,9S,10R,13R,14S,17R)-17-[(1R)-1,5-dimethylhexyl]-3-methoxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-6-ol")
