| SpectraBase Spectrum ID |
KTBW0eMLzE3 |
| Name |
Trisnorhopan-21.beta.-one |
| Alternate Name(s) |
17.alpha.H-Trisnorhopan-21-one |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C27H44O |
| InChI |
InChI=1S/C27H44O/c1-23(2)13-7-14-25(4)20(23)12-17-27(6)22(25)9-8-21-24(3)15-11-19(28)18(24)10-16-26(21,27)5/h18,20-22H,7-17H2,1-6H3/t18-,20?,21?,22?,24+,25+,26-,27-/m1/s1 |
| InChIKey |
QHZGEIFOKNRJQD-NQWPCQSOSA-N |
| Molecular Weight |
384.648 g/mol |
| SMILES |
[C@@]12([C@]3(C([C@]4(CCC([C@]4(CC3)[H])=O)C)CCC1[C@]1(CCCC(C1CC2)(C)C)C)C)C |
| SPLASH |
splash10-0006-0902000000-95dd259651f3db1ee5c9 |
| Source of Spectrum |
E1-40-1684-0 |
| Wiley ID |
1519531 |
