| SpectraBase Spectrum ID |
H1J0ZwPOddy |
| Name |
Benzoic acid, 2,4-dihydroxy-6-(2-oxopentyl)-, 4-carboxy-3-hydroxy-5-(2-oxopentyl)phenyl ester |
| CAS Registry Number |
127743-55-9 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C24H26O9 |
| InChI |
InChI=1S/C24H26O9/c1-3-5-15(25)7-13-9-17(27)11-19(28)22(13)24(32)33-18-10-14(8-16(26)6-4-2)21(23(30)31)20(29)12-18/h9-12,27-29H,3-8H2,1-2H3,(H,30,31) |
| InChIKey |
XKZXRAVNBWFZRU-UHFFFAOYSA-N |
| Molecular Weight |
458.463 g/mol |
| SMILES |
Oc1cc(OC(c2c(cc(cc2CC(=O)CCC)O)O)=O)cc(c1C(=O)O)CC(=O)CCC |
| SPLASH |
splash10-00di-3920000000-7545828cb85b17625e0f |
| Source of Spectrum |
B-42-1981-6 |
| Synonyms |
2-(propylcarbonylmethyl)-4-(6'-(propylcarbonylmethyl)-2',4'-dihydroxybenzoyloxy)-6-hydroxybenzoic acid
4-O-demethylglomellic acid
4-{[2,4-dihydroxy-6-(2-oxopentyl)benzoyl]oxy}-2-hydroxy-6-(2-oxopentyl)benzoic acid |
| Wiley ID |
1389841 |
