| SpectraBase Spectrum ID |
2dxkJN318Wf |
| Name |
Benzoic acid, 4-[(3,4-dihydroxy-6-methoxy-2-methylbenzoyl)oxy]-2-hydroxy-6-methyl-, 4-carboxy-3-hydroxy-5-methylphenyl ester |
| CAS Registry Number |
125287-11-8 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C25H22O11 |
| InChI |
InChI=1S/C25H22O11/c1-10-5-13(7-15(26)19(10)23(30)31)35-24(32)20-11(2)6-14(8-16(20)27)36-25(33)21-12(3)22(29)17(28)9-18(21)34-4/h5-9,26-29H,1-4H3,(H,30,31) |
| InChIKey |
YKNSQSGHUSVTPQ-UHFFFAOYSA-N |
| Molecular Weight |
498.440 g/mol |
| SMILES |
Oc1cc(cc(c1C(Oc1cc(c(C(=O)O)c(c1)O)C)=O)C)OC(c1c(c(O)c(cc1OC)O)C)=O |
| SPLASH |
splash10-00di-0900000000-705e38b2c56f7ff2a3c5 |
| Source of Spectrum |
B-42-1425-6 |
| Synonyms |
2-O-methylhiascic acid
4-({4-[(3,4-dihydroxy-6-methoxy-2-methylbenzoyl)oxy]-2-hydroxy-6-methylbenzoyl}oxy)-2-hydroxy-6-methylbenzoic acid
6-Methyl-4-[2'-methyl-4'-(2''-methoxy-4'',5''-dihydroxy-6''-methylbenzoyl)oxy-6'-hydroxybenzoyl]oxy-2-hydroxybenzoic acid |
| Wiley ID |
1398515 |
![Benzoic acid, 4-[(3,4-dihydroxy-6-methoxy-2-methylbenzoyl)oxy]-2-hydroxy-6-methyl-, 4-carboxy-3-hydroxy-5-methylphenyl ester](/api/spectrum/2dxkJN318Wf/structure.png?h=300&w=458 "Benzoic acid, 4-[(3,4-dihydroxy-6-methoxy-2-methylbenzoyl)oxy]-2-hydroxy-6-methyl-, 4-carboxy-3-hydroxy-5-methylphenyl ester")
