| SpectraBase Spectrum ID |
JBm3XV20Dll |
| Name |
4-Octanone, 5-(acetyloxy)-7-[(3.beta.,5.alpha.,17.beta.)-3-methoxyandrostan-17-yl]-2-methyl-, [S-(R*,S*)]- |
| Alternate Name(s) |
Androstane, 4-octanone deriv.
(23S)-3.beta.methoxy-23-acetoxy-26,26-dimethyl-27-nor-5.alpha.-cholestan-24-one
(2R,4S)-2-[(1S,2S,5S,7S,10R,11S,14R,15R)-5-methoxy-2,15-dimethyltetracyclo[8.7.0.0(2,7).0(11,15)]heptadecan-14-yl]-7-methyl-5-oxooctan-4-yl acetate |
| CAS Registry Number |
124580-45-6 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C31H52O4 |
| InChI |
InChI=1S/C31H52O4/c1-19(2)16-28(33)29(35-21(4)32)17-20(3)25-10-11-26-24-9-8-22-18-23(34-7)12-14-30(22,5)27(24)13-15-31(25,26)6/h19-20,22-27,29H,8-18H2,1-7H3/t20-,22+,23+,24+,25-,26+,27+,29+,30+,31-/m1/s1 |
| InChIKey |
GJUWNGJLKPQJFN-MRWNTWOKSA-N |
| Molecular Weight |
488.753 g/mol |
| SMILES |
[C@@]12([C@]([C@@]3(CC[C@@]4([C@@]([C@]3(CC2)[H])(CC[C@](OC)(C4)[H])C)[H])[H])(CC[C@@]1([C@@](C[C@@](C(CC(C)C)=O)(OC(=O)C)[H])(C)[H])[H])[H])C |
| SPLASH |
splash10-0a4i-8910000000-36a13e10ec59f6defc64 |
| Source of Spectrum |
C-112-310-32 |
| Wiley ID |
1396984 |
![4-Octanone, 5-(acetyloxy)-7-[(3.beta.,5.alpha.,17.beta.)-3-methoxyandrostan-17-yl]-2-methyl-, [S-(R*,S*)]-](/api/spectrum/JBm3XV20Dll/structure.png?h=300&w=458 "4-Octanone, 5-(acetyloxy)-7-[(3.beta.,5.alpha.,17.beta.)-3-methoxyandrostan-17-yl]-2-methyl-, [S-(R*,S*)]-")
