Cryptochlorophaeic acid
2,4-dihydroxy-3-(4-hydroxy-2-methoxy-6-pentylbenzoyl)oxy-6-pentylbenzoic acid
Also Known As: Cryptochlorophaeic acid|Cryptochloropheic acid|2,4-dihydroxy-3-(4-hydroxy-2-methoxy-6-pentylbenzoyl)oxy-6-pentylbenzoic acid|o-Anisic acid, 4-hydroxy-6-pentyl-, 3-ester with 2,3,4-trihydroxy-6-pentylbenzoic acid|Benzoic acid, 2,4-dihydroxy-3-[(4-hydroxy-2-methoxy-6-pentylbenzoyl)oxy]-6-pentyl-|2,4-Dihydroxy-3-(2-methoxy-4-hydroxy-6-pentylbenzoyloxy)-6-pentylbenzoic acid|2,4-dihydroxy-3-(4-hydroxy-2-methoxy-6-pentylbenzoyloxy)-6-pentylbenzoic acid|2,4-Dihydroxy-3-[(4-hydroxy-2-methoxy-6-pentylbenzoyl)oxy]-6-pentylbenzoic acid|2,4-Dihydroxy-3-[(4-hydroxy-2-methoxy-6-pentylbenzoyl)oxy]-6-pentylbenzoic acid #|Benzoic acid, 2,4-dihydroxy-3-((4-hydroxy-2-methoxy-6-pentylbenzoyl)oxy)-6-pentyl-|o-Anisicacid,4-hydroxy-6-pentyl-,3-esterwith2,3,4-trihydroxy-6-pentylbenzoicacid
| Molecular Formula | C25H32O8 |
|---|---|
| Molecular Weight | 460.20972 g/mol |
| LogP | 7.2 |
| Topological Polar Surface Area | 134.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 13 |
| Exact Mass | 460.20972 |
| Monoisotopic Mass | 460.20972 |
| Heavy Atoms | 33 |
| Complexity | 611.0 |
Chemical Identifiers
| CAS Number | 2948-07-4 |
|---|---|
| SMILES | CCCCCC1=CC(=C(C(=C1C(=O)O)O)OC(=O)C2=C(C=C(C=C2OC)O)CCCCC)O |
| InChIKey | LPYVRTMCNJPGMF-UHFFFAOYSA-N |
Product Overview
Cryptochlorophaeic acid (CAS 2948-07-4), with molecular formula C25H32O8 and molecular weight 460.20972 g/mol. IUPAC: 2,4-dihydroxy-3-(4-hydroxy-2-methoxy-6-pentylbenzoyl)oxy-6-pentylbenzoic acid.