| SpectraBase Spectrum ID |
2ekVGS8ElTj |
| Name |
Ochraceolide B |
| Alternate Name(s) |
(1R,2R,5R,10R,11R,14S,15R,16S,20R,22S)-1,2,6,6,10,22-hexamethyl-19-oxaspiro[hexacyclo[12.10.0.0(2,11).0(5,10).0(15,22).0(16,20)]tetracosane-17,2'-oxirane]-7,18-dione
20,19-Epoxy-3-oxolupan-30,21.alpha.-olide |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C30H44O4 |
| InChI |
InChI=1S/C30H44O4/c1-25(2)19-9-12-29(6)20(27(19,4)11-10-21(25)31)8-7-17-22-23-18(34-24(32)30(23)16-33-30)15-26(22,3)13-14-28(17,29)5/h17-20,22-23H,7-16H2,1-6H3/t17-,18+,19-,20+,22+,23+,26-,27-,28+,29+,30?/m0/s1 |
| InChIKey |
BSKDFVKLMLKTPZ-AIAQPURWSA-N |
| Molecular Weight |
468.678 g/mol |
| SMILES |
C12([C@]3([C@]4([C@]5([C@@]([C@@]6(CC[C@@]7([C@@]([C@]6(CC5)[H])(CCC(=O)C7(C)C)C)[H])C)(C)CC[C@@]4(C)C[C@]3(OC1=O)[H])[H])[H])[H])OC2 |
| SPLASH |
splash10-0006-9041200000-02584d64fb060ed731dd |
| Source of Spectrum |
X2-54-1358-2 |
| Wiley ID |
1604198 |
