| SpectraBase Spectrum ID |
7sVkgyFNo3A |
| Name |
(3S,5S,9R,10S,13R,14R,17R)-17-[(E,1R,4R)-4-(2-hydroxyethyl)-1,5-dimethyl-hex-2-enyl]-10,13-dimethyl-2,3,4,5,6,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol |
| Alternate Name(s) |
(22E,24S)-3.beta.,29-dihydroxy-5a-stigmasta-7,22-diene
(22E,24R)-3.beta.,29-dihydroxy-5.alpha.-stigmasta-7,22-diene
Stigmasta-7,22-diene-3,29-diol, (3.beta.,5.alpha.,22E,24R)-
(3S,5S,9R,10S,13R,14R,17R)-17-[(E,2R,5R)-5-(2-hydroxyethyl)-6-methyl-hept-3-en-2-yl]-10,13-dimethyl-2,3,4,5,6,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol
(3S,5S,9R,10S,13R,14R,17R)-17-[(E,2R,5R)-5-(2-hydroxyethyl)-6-methylhept-3-en-2-yl]-10,13-dimethyl-2,3,4,5,6,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol |
| CAS Registry Number |
108160-27-6 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C29H48O2 |
| InChI |
InChI=1S/C29H48O2/c1-19(2)21(14-17-30)7-6-20(3)25-10-11-26-24-9-8-22-18-23(31)12-15-28(22,4)27(24)13-16-29(25,26)5/h6-7,9,19-23,25-27,30-31H,8,10-18H2,1-5H3/b7-6+/t20-,21-,22+,23+,25-,26+,27+,28+,29-/m1/s1 |
| InChIKey |
FRTCDNFAHNPZBV-GIYWOASVSA-N |
| Molecular Weight |
428.701 g/mol |
| SMILES |
OCC[C@@](\C=C\[C@]([C@@]1([C@@]2([C@](C3=CC[C@]4(C[C@](CC[C@@]4([C@]3(CC2)[H])C)(O)[H])[H])(CC1)[H])C)[H])(C)[H])(C(C)C)[H] |
| SPLASH |
splash10-00di-0090200000-2606da9f1d46fd66a42a |
| Source of Spectrum |
F-42-4846-4 |
| Wiley ID |
1380955 |
![(3S,5S,9R,10S,13R,14R,17R)-17-[(E,1R,4R)-4-(2-hydroxyethyl)-1,5-dimethyl-hex-2-enyl]-10,13-dimethyl-2,3,4,5,6,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol](/api/spectrum/7sVkgyFNo3A/structure.png?h=300&w=458 "(3S,5S,9R,10S,13R,14R,17R)-17-[(E,1R,4R)-4-(2-hydroxyethyl)-1,5-dimethyl-hex-2-enyl]-10,13-dimethyl-2,3,4,5,6,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol")
