| SpectraBase Spectrum ID |
8msbutEQ35a |
| Name |
4-O-demethylsuperconfluentic acid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C31H42O8 |
| InChI |
InChI=1S/C31H42O8/c1-4-6-8-10-12-14-21-18-25(20-27(38-3)29(21)30(35)36)39-31(37)28-22(17-24(33)19-26(28)34)16-23(32)15-13-11-9-7-5-2/h17-20,33-34H,4-16H2,1-3H3,(H,35,36) |
| InChIKey |
ROVDQKWYUMFMFC-UHFFFAOYSA-N |
| Molecular Weight |
542.669 g/mol |
| SMILES |
OC(c1c(cc(OC(c2c(cc(cc2CC(=O)CCCCCCC)O)O)=O)cc1CCCCCCC)OC)=O |
| SPLASH |
splash10-0019-0900000000-bced85f4f3fde2f03f98 |
| Source of Spectrum |
JA-49-917-0 |
| Synonyms |
4-{[2,4-dihydroxy-6-(2-oxononyl)benzoyl]oxy}-2-heptyl-6-methoxybenzoic acid |
| Wiley ID |
1404863 |
