| SpectraBase Spectrum ID |
Knxnr3sCsBE |
| Name |
Benzoic acid, 6-hydroxy-3-[(2-hydroxy-4-methoxy-6-propylbenzoyl)oxy]-4-(phenylmethoxy)-2-propyl-, methyl ester |
| CAS Registry Number |
113487-79-9 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C29H32O8 |
| InChI |
InChI=1S/C29H32O8/c1-5-10-19-14-20(34-3)15-22(30)25(19)29(33)37-27-21(11-6-2)26(28(32)35-4)23(31)16-24(27)36-17-18-12-8-7-9-13-18/h7-9,12-16,30-31H,5-6,10-11,17H2,1-4H3 |
| InChIKey |
UMAVWUWQMZRIEO-UHFFFAOYSA-N |
| Molecular Weight |
508.567 g/mol |
| SMILES |
Oc1c(C(Oc2c(c(c(cc2OCc2ccccc2)O)C(=O)OC)CCC)=O)c(cc(c1)OC)CCC |
| SPLASH |
splash10-0006-0900010000-0740343ec1c44c508685 |
| Source of Spectrum |
B-40-1461-32 |
| Synonyms |
methyl 4-(benzyloxy)-6-hydroxy-3-[(2-hydroxy-4-methoxy-6-propylbenzoyl)oxy]-2-propylbenzoate
Methyl 4-benzyloxy-3-[2'-hydroxy-4'-methoxy-6'-propylbenzoyloxy)-6-hydroxy-2-propylbenzoate |
| Wiley ID |
1400189 |
![Benzoic acid, 6-hydroxy-3-[(2-hydroxy-4-methoxy-6-propylbenzoyl)oxy]-4-(phenylmethoxy)-2-propyl-, methyl ester](/api/spectrum/Knxnr3sCsBE/structure.png?h=300&w=458 "Benzoic acid, 6-hydroxy-3-[(2-hydroxy-4-methoxy-6-propylbenzoyl)oxy]-4-(phenylmethoxy)-2-propyl-, methyl ester")
