| SpectraBase Spectrum ID |
AqHkc8ElNKJ |
| Name |
Benzoic acid, 2-hydroxy-4-[[2-hydroxy-4-methoxy-6-(3-oxopentyl)benzoyl]oxy]-6-pentyl-, phenylmethyl ester |
| CAS Registry Number |
105705-18-8 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C32H36O8 |
| InChI |
InChI=1S/C32H36O8/c1-4-6-8-13-22-17-26(19-28(35)29(22)31(36)39-20-21-11-9-7-10-12-21)40-32(37)30-23(14-15-24(33)5-2)16-25(38-3)18-27(30)34/h7,9-12,16-19,34-35H,4-6,8,13-15,20H2,1-3H3 |
| InChIKey |
PIBPFSSRBFZGJR-UHFFFAOYSA-N |
| Molecular Weight |
548.632 g/mol |
| SMILES |
Oc1cc(OC(c2c(cc(cc2CCC(=O)CC)OC)O)=O)cc(c1C(OCc1ccccc1)=O)CCCCC |
| SPLASH |
splash10-0006-9031000000-eddcc8bb1335db1343ca |
| Source of Spectrum |
B-39-796-20 |
| Synonyms |
4-[(benzyloxy)carbonyl]-3-hydroxy-5-pentylphenyl 2-hydroxy-4-methoxy-6-(3-oxopentyl)benzoate
Benzyl 2-hydroxy-4-[2-hydroxy-4-methoxy-6-(3-oxopentyl)benzoyloxy]-6-pentylbenzoate |
| Wiley ID |
1405500 |
![Benzoic acid, 2-hydroxy-4-[[2-hydroxy-4-methoxy-6-(3-oxopentyl)benzoyl]oxy]-6-pentyl-, phenylmethyl ester](/api/spectrum/AqHkc8ElNKJ/structure.png?h=300&w=458 "Benzoic acid, 2-hydroxy-4-[[2-hydroxy-4-methoxy-6-(3-oxopentyl)benzoyl]oxy]-6-pentyl-, phenylmethyl ester")
