SpectraBase Spectrum ID |
FSlb1ukBC6m |
Name |
Licorisoflavan-A;3',6-diprenyl-2',4'-dihydroxy-5,7-dimethoxyisoflavan |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
438.240624190 u |
Formula |
C27H34O5 |
InChI |
InChI=1S/C27H34O5/c1-16(2)7-9-20-23(28)12-11-19(26(20)29)18-13-22-25(32-15-18)14-24(30-5)21(27(22)31-6)10-8-17(3)4/h7-8,11-12,14,18,28-29H,9-10,13,15H2,1-6H3 |
InChIKey |
GDAAEAXMNLVRCZ-UHFFFAOYSA-N |
Molecular Weight |
438.564 g/mol |
SMILES |
C1(OC)=CC=2OCC(C3=CC=C(O)C(CC=C(C)C)=C3O)CC2C(OC)=C1CC=C(C)C |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.828944 |