| SpectraBase Spectrum ID |
BXWoWtrMZ4Y |
| Name |
Benzoic acid, 3-[2-carboxy-3-pentyl-5-(phenylmethoxy)phenoxy]-6-hydroxy-4-methoxy-2-pentyl-, 1-(phenylmethyl) ester |
| CAS Registry Number |
124281-33-0 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C39H44O8 |
| InChI |
InChI=1S/C39H44O8/c1-4-6-10-20-29-22-30(45-25-27-16-12-8-13-17-27)23-33(35(29)38(41)42)47-37-31(21-11-7-5-2)36(32(40)24-34(37)44-3)39(43)46-26-28-18-14-9-15-19-28/h8-9,12-19,22-24,40H,4-7,10-11,20-21,25-26H2,1-3H3,(H,41,42) |
| InChIKey |
PJUWOVDFBXMWPA-UHFFFAOYSA-N |
| Molecular Weight |
640.773 g/mol |
| SMILES |
OC(c1c(Oc2c(c(c(cc2OC)O)C(OCc2ccccc2)=O)CCCCC)cc(cc1CCCCC)OCc1ccccc1)=O |
| SPLASH |
splash10-0006-9000036000-ca729631ab030e2e8dad |
| Source of Spectrum |
B-42-993-18 |
| Synonyms |
4-(benzyloxy)-2-{3-[(benzyloxy)carbonyl]-4-hydroxy-6-methoxy-2-pentylphenoxy}-6-pentylbenzoic acid
4-Benzyloxy-2-(3'-benzyloxycarbonyl-4'-hydroxy-6'-methoxy-2'-pentylphenoxy)-6-pentylbenzoic acid |
| Wiley ID |
1412656 |
![Benzoic acid, 3-[2-carboxy-3-pentyl-5-(phenylmethoxy)phenoxy]-6-hydroxy-4-methoxy-2-pentyl-, 1-(phenylmethyl) ester](/api/spectrum/BXWoWtrMZ4Y/structure.png?h=300&w=458 "Benzoic acid, 3-[2-carboxy-3-pentyl-5-(phenylmethoxy)phenoxy]-6-hydroxy-4-methoxy-2-pentyl-, 1-(phenylmethyl) ester")
