| SpectraBase Spectrum ID |
4THtyP1CirS |
| Name |
Casbene-diterpenoid |
| Alternate Name(s) |
1,4-Dihydroxy-5-oxo-2,6,12,15,15-pentamethyl-bicyclo[12.1.o]pentadeca-2,6,12-triene |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C20H30O3 |
| InChI |
InChI=1S/C20H30O3/c1-12-6-8-15-16(20(15,4)5)10-14(3)19(23)18(22)11-13(2)17(21)9-7-12/h7,10-11,15-18,21-22H,6,8-9H2,1-5H3/b12-7+,13-11+,14-10-/t15?,16?,17-,18+/m1/s1 |
| InChIKey |
NGYQHXUVEHURAE-AVTXBLSPSA-N |
| Molecular Weight |
318.457 g/mol |
| SMILES |
O[C@]1(\C=C\([C@@](C\C=C\(CCC2C(C2\C=C/(C1=O)C)(C)C)C)(O)[H])C)[H] |
| SPLASH |
splash10-0ab9-1900000000-f6991270e5672e87c9d5 |
| Source of Spectrum |
X2-53-1570-1 |
| Wiley ID |
1603817 |
