| SpectraBase Spectrum ID |
DYbwVZAyMxw |
| Name |
(1,3-Dihydroxy-6,8A-dimethyl-3-propan-2-yl-1,2,3A,4,5,8-hexahydroazulen-4-yl) 4-hydroxybenzoate, 2ac derivative |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
458.230453428 u |
| Formula |
C26H34O7 |
| InChI |
InChI=1S/C26H34O7/c1-15(2)26(30)14-22(32-18(5)28)25(6)12-11-16(3)13-21(23(25)26)33-24(29)19-7-9-20(10-8-19)31-17(4)27/h7-11,15,21-23,30H,12-14H2,1-6H3 |
| InChIKey |
LREXBYWKWULCGU-UHFFFAOYSA-N |
| Molecular Weight |
458.551 g/mol |
| SMILES |
C1=C(C=CC(=C1)C(OC1C2C(CC=C(C1)C)(C(CC2(C(C)C)O)OC(C)=O)C)=O)OC(=O)C |
