| SpectraBase Spectrum ID |
15jHkM72hay |
| Name |
Benzoic acid, 3,4,6-trihydroxy-2-methyl-, 4-carboxy-3-hydroxy-5-methylphenyl ester |
| CAS Registry Number |
65614-62-2 |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C16H14O8 |
| InChI |
InChI=1S/C16H14O8/c1-6-3-8(4-9(17)12(6)15(21)22)24-16(23)13-7(2)14(20)11(19)5-10(13)18/h3-5,17-20H,1-2H3,(H,21,22) |
| InChIKey |
ROFBXDQOPDYPQI-UHFFFAOYSA-N |
| Molecular Weight |
334.280 g/mol |
| SMILES |
Oc1cc(OC(c2c(cc(c(c2C)O)O)O)=O)cc(c1C(=O)O)C |
| SPLASH |
splash10-0uxr-2900000000-fb3e19adeeff4844e9db |
| Source of Spectrum |
B-30-2704-0 |
| Synonyms |
2-Hydroxy-6-methyl-4-[(3,4,6-trihydroxy-2-methylbenzoyl)oxy]benzoic acid
5-Hydroxylecanoric acid |
| Wiley ID |
1330720 |
