| SpectraBase Spectrum ID |
GlhPKYNimze |
| Name |
(-)-(3R,4R,5R)-3-(3',4'-methylenedioxybenzyl)-4-(3'',4''-dimethoxybenzyl)-5-(1-menthyloxy)butyrolactone |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
524.277403621 u |
| Formula |
C31H40O7 |
| InChI |
InChI=1S/C31H40O7/c1-19(2)22-10-12-31(3,13-11-22)38-30-24(15-21-6-8-25(33-4)27(16-21)34-5)23(29(32)37-30)14-20-7-9-26-28(17-20)36-18-35-26/h6-9,16-17,19,22-24,30H,10-15,18H2,1-5H3/t22?,23-,24-,30+,31?/m1/s1 |
| InChIKey |
VDXMKDIGTZRROM-RJZRQGSMSA-N |
| Molecular Weight |
524.654 g/mol |
| SMILES |
[C@@]1(OC([C@@]([C@]1(CC=1C=C(OC)C(=CC1)OC)[H])(CC=1C=C2OCOC2=CC1)[H])=O)(OC1(CCC(CC1)C(C)C)C)[H] |
