| SpectraBase Spectrum ID |
A0sHOuwIKCf |
| Name |
Benzyl 3-benzyloxy-4-O-methylumbilicarate |
| Alternate Name(s) |
4-({4-[(benzyloxy)carbonyl]-3-hydroxy-5-methylphenoxy}carbonyl)-3-hydroxy-5-methylphenyl 3-(benzyloxy)-2,4-dimethoxy-6-methylbenzoate |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C40H36O11 |
| InChI |
InChI=1S/C40H36O11/c1-23-16-28(19-30(41)33(23)38(43)49-22-27-14-10-7-11-15-27)50-39(44)34-24(2)17-29(20-31(34)42)51-40(45)35-25(3)18-32(46-4)36(37(35)47-5)48-21-26-12-8-6-9-13-26/h6-20,41-42H,21-22H2,1-5H3 |
| InChIKey |
FGJQOLRBAQJKCA-UHFFFAOYSA-N |
| Molecular Weight |
692.717 g/mol |
| SMILES |
Oc1cc(cc(c1C(Oc1cc(c(c(c1)C)C(OCc1ccccc1)=O)O)=O)C)OC(c1c(c(OCc2ccccc2)c(cc1C)OC)OC)=O |
| SPLASH |
splash10-0006-9000000000-b59df5da900d0b710ffb |
| Source of Spectrum |
B-51-1049-24 |
| Wiley ID |
745871 |
