SpectraBase Spectrum ID |
MDFLLjLUq5 |
Name |
Chamalignolide [(8R,8'R)-2-.beta.-(3',4'-methylenedioxybenzyl)-3.alpha.-(4"-hydroxybenzyl)-.gamma.-butyrolactone] |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C19H18O5 |
InChI |
InChI=1S/C19H18O5/c20-15-4-1-12(2-5-15)7-14-10-22-19(21)16(14)8-13-3-6-17-18(9-13)24-11-23-17/h1-6,9,14,16,20H,7-8,10-11H2/t14-,16?/m0/s1 |
InChIKey |
JWXJFUFJIWOGCK-LBAUFKAWSA-N |
Molecular Weight |
326.348 g/mol |
SMILES |
Oc1ccc(C[C@@]2(C(C(OC2)=O)Cc2cc3OCOc3cc2)[H])cc1 |
SPLASH |
splash10-000i-1901000000-a40d4bf0177674eed6cd |
Source of Spectrum |
E2-50-980-2 |
Wiley ID |
1555929 |