| SpectraBase Spectrum ID |
KaIkIh7WjzC |
| Name |
11,19-Dihydroxy-abieta-5,7,9(11),13-tetraen-12-one, 19-o-vanilloate |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
464.219888744 u |
| Formula |
C28H32O6 |
| InChI |
InChI=1S/C28H32O6/c1-16(15-34-26(32)18-7-9-20(29)21(14-18)33-5)19-13-17-8-10-22-27(2,3)11-6-12-28(22,4)23(17)25(31)24(19)30/h7-10,13-14,16,29,31H,6,11-12,15H2,1-5H3 |
| InChIKey |
TZHONMUSYWYXKI-UHFFFAOYSA-N |
| Molecular Weight |
464.558 g/mol |
| SMILES |
C1CC(C=2C(C1)(C)C=1C(C=C(C(C1O)=O)C(C)COC(C1=CC(=C(C=C1)O)OC)=O)=CC2)(C)C |
