| SpectraBase Spectrum ID |
BeElieXK69E |
| Name |
Thunberginol C triacetate |
| Alternate Name(s) |
Acetic acid [4-(6,8-diacetyloxy-1-oxo-3,4-dihydro-1H-2-benzopyran-3-yl)phenyl] ester
[4-(6,8-diacetyloxy-1-oxo-3,4-dihydroisochromen-3-yl)phenyl] acetate
[4-(6,8-diacetoxy-1-oxo-isochroman-3-yl)phenyl] acetate
[4-(6,8-diacetyloxy-1-oxidanylidene-3,4-dihydroisochromen-3-yl)phenyl] ethanoate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H18O8 |
| InChI |
InChI=1S/C21H18O8/c1-11(22)26-16-6-4-14(5-7-16)18-9-15-8-17(27-12(2)23)10-19(28-13(3)24)20(15)21(25)29-18/h4-8,10,18H,9H2,1-3H3 |
| InChIKey |
IPZJMMBKSCRMSM-UHFFFAOYSA-N |
| Molecular Weight |
398.367 g/mol |
| SMILES |
C1(c2c(cc(cc2CC(O1)c1ccc(OC(=O)C)cc1)OC(=O)C)OC(=O)C)=O |
| SPLASH |
splash10-08fr-0019000000-ab697cf9567af1782d33 |
| Source of Spectrum |
E1-44-1445-13 |
| Wiley ID |
1553476 |
