| SpectraBase Spectrum ID |
KhI3xy1ysbS |
| Name |
26,27-Dinorcholest-5-en-23-yn-3-ol, acetate, (3.beta.)- |
| Alternate Name(s) |
(1S,2R,5S,10S,11S,14R,15R)-14-[(2R)-hex-4-yn-2-yl]-2,15-dimethyltetracyclo[8.7.0.0(2,7).0(11,15)]heptadec-7-en-5-yl acetate
26,27-Dinorcholest-5-en-23-yn-3.beta.-yl acetate |
| CAS Registry Number |
63015-88-3 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C27H40O2 |
| InChI |
InChI=1S/C27H40O2/c1-6-7-8-18(2)23-11-12-24-22-10-9-20-17-21(29-19(3)28)13-15-26(20,4)25(22)14-16-27(23,24)5/h9,18,21-25H,8,10-17H2,1-5H3/t18-,21+,22+,23-,24+,25+,26+,27-/m1/s1 |
| InChIKey |
IFPDQKQYBIEASN-NVVJDQLXSA-N |
| Molecular Weight |
396.615 g/mol |
| SMILES |
[C@@]12([C@]([C@@]3(CC=C4[C@@]([C@]3(CC2)[H])(CC[C@](OC(=O)C)(C4)[H])C)[H])(CC[C@@]1([C@@](CC#CC)(C)[H])[H])[H])C |
| SPLASH |
splash10-000i-0039000000-11fd657f057e96603551 |
| Source of Spectrum |
H-60-480-0 |
| Wiley ID |
1367747 |
