| SpectraBase Spectrum ID |
4cSaiDr0ivb |
| Name |
13.beta.-Fluoro-3,22-oleananedione |
| Alternate Name(s) |
13-fluorooleanane-3,22-dione |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C30H47FO2 |
| InChI |
InChI=1S/C30H47FO2/c1-24(2)17-21-27(6,23(33)18-24)15-16-29(8)28(7)13-9-19-25(3,4)22(32)11-12-26(19,5)20(28)10-14-30(21,29)31/h19-21H,9-18H2,1-8H3/t19-,20+,21+,26-,27+,28+,29-,30-/m0/s1 |
| InChIKey |
UUOHRSGTLTVSGG-UEIHGOKBSA-N |
| Molecular Weight |
458.702 g/mol |
| SMILES |
[C@@]12([C@]([C@@]3(CC[C@@]4([C@@]([C@]3(CC2)[H])(CCC(=O)C4(C)C)C)[H])C)(CC[C@@]2([C@]1(CC(CC2=O)(C)C)[H])C)C)F |
| SPLASH |
splash10-05ur-3290100000-d58d9949a3e35674fed9 |
| Source of Spectrum |
J-59-2335-34 |
| Wiley ID |
1390021 |
