| SpectraBase Spectrum ID |
AtFXK8Ht4D9 |
| Name |
A-Homo-1-oxa-5,6-secocholest-3-en-2-one, 6,6-bis(acetyloxy)-, (10.alpha.)- |
| CAS Registry Number |
84681-07-2 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C31H50O6 |
| InChI |
InChI=1S/C31H50O6/c1-9-24-26-16-15-25(21(4)13-10-12-20(2)3)29(26,7)19-17-27(24)30(8)31(35-22(5)32,36-23(6)33)18-11-14-28(34)37-30/h11,14,20-21,24-27H,9-10,12-13,15-19H2,1-8H3/t21-,24?,25-,26?,27?,29-,30-/m1/s1 |
| InChIKey |
VXZOVVMQDGTWBF-CCRDJAMDSA-N |
| Molecular Weight |
518.735 g/mol |
| SMILES |
C1([C@@](C2C(C3CC[C@@]([C@]3(CC2)C)([C@@](CCCC(C)C)(C)[H])[H])CC)(OC(=O)C=CC1)C)(OC(=O)C)OC(=O)C |
| SPLASH |
splash10-002k-0938500000-ac298ed30c86021e9207 |
| Source of Spectrum |
C-105-1978-0 |
| Synonyms |
(2R)-3-(acetyloxy)-2-{(1R,7aR)-1-[(1R)-1,5-dimethylhexyl]-4-ethyl-7a-methyloctahydro-1H-inden-5-yl}-2-methyl-7-oxo-2,3,4,7-tetrahydro-3-oxepinyl acetate
6,6-Diacetoxy-10-hydroxy-5,6:5,10-disecocholest-3-en-5-oic
Oxepin, a-homo-1-oxa-5,6-secocholest-3-en-2-one deriv. |
| Wiley ID |
1401756 |
