| SpectraBase Spectrum ID |
6YPqBISAyMQ |
| Name |
1H-Cyclopenta[5,6]naphth[2,1-c]oxepin, A-homo-4-oxacholest-5-ene-3,7-diol deriv. |
| CAS Registry Number |
113680-66-3 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C27H46O3 |
| InChI |
InChI=1S/C27H46O3/c1-17(2)7-6-8-18(3)20-9-10-21-25-22(11-13-27(20,21)5)26(4)14-12-24(29)30-16-19(26)15-23(25)28/h15,17-18,20-25,28-29H,6-14,16H2,1-5H3/t18-,20-,21+,22+,23-,24-,25+,26+,27-/m1/s1 |
| InChIKey |
HVEISQBNNIKICS-QHDXZFEXSA-N |
| Molecular Weight |
418.662 g/mol |
| SMILES |
O[C@]1(CC[C@]2(C(=C[C@]([C@]3([C@]4([C@](CC[C@]23[H])([C@](CC4)([C@@](CCCC(C)C)(C)[H])[H])C)[H])[H])(O)[H])CO1)C)[H] |
| SPLASH |
splash10-0pb9-9005300000-eba7d3bb507888e769f2 |
| Source of Spectrum |
AJ-60-1080-17 |
| Synonyms |
A-Homo-4-oxacholest-5-ene-3,7-diol, (3.beta.,7.alpha.)-
(3R,5aR,5bS,7aR,8R,10aS,10bS,11S)-8-[(1R)-1,5-dimethylhexyl]-5a,7a-dimethyl-3,4,5,5a,5b,6,7,7a,8,9,10,10a,10b,11-tetradecahydro-1H-cyclopenta[5,6]naphtho[2,1-c]oxepin-3,11-diol
4-Oxa-a-homocholest-5-en-3,7-diol |
| Wiley ID |
1377463 |
![1H-Cyclopenta[5,6]naphth[2,1-c]oxepin, A-homo-4-oxacholest-5-ene-3,7-diol deriv.](/api/spectrum/6YPqBISAyMQ/structure.png?h=300&w=458 "1H-Cyclopenta[5,6]naphth[2,1-c]oxepin, A-homo-4-oxacholest-5-ene-3,7-diol deriv.")
