| SpectraBase Spectrum ID |
afn3j5MIjA |
| Name |
Benzoic acid, 3-chloro-2-hydroxy-4-methoxy-6-propyl-, 4-carboxy-3-hydroxy-5-pentylphenyl ester |
| CAS Registry Number |
120091-96-5 |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C23H27ClO7 |
| InChI |
InChI=1S/C23H27ClO7/c1-4-6-7-9-14-10-15(12-16(25)18(14)22(27)28)31-23(29)19-13(8-5-2)11-17(30-3)20(24)21(19)26/h10-12,25-26H,4-9H2,1-3H3,(H,27,28) |
| InChIKey |
GRJYBTKQNYRIDT-UHFFFAOYSA-N |
| Molecular Weight |
450.915 g/mol |
| SMILES |
Oc1cc(cc(c1C(=O)O)CCCCC)OC(c1c(c(Cl)c(cc1CCC)OC)O)=O |
| SPLASH |
splash10-004i-0390000000-4139890c97de7a9fe5c4 |
| Source of Spectrum |
B-41-1794-2 |
| Synonyms |
3-Chlorostenosporic acid
4-(3'-Chloro-2'-hydroxy-4'-methoxy-6'-propylbenzoyloxy)-2-hydroxy-6-pentylbenzoic acid
4-[(3-chloro-2-hydroxy-4-methoxy-6-propylbenzoyl)oxy]-2-hydroxy-6-pentylbenzoic acid |
| Wiley ID |
1387639 |
