Epiphorellic acid 1
6-hydroxy-3-(5-hydroxy-2-methoxycarbonyl-3-pentylphenoxy)-4-methoxy-2-pentylbenzoic acid
Also Known As: Epiphorellic acid 1|Epiforellic 1 acid|5-[5-Hydroxy-2-(methoxycarbonyl)-3-pentylphenoxy]-4-methoxy-6-pentylsalicylic acid|6-hydroxy-3-(5-hydroxy-2-methoxycarbonyl-3-pentylphenoxy)-4-methoxy-2-pentylbenzoic acid|6-hydroxy-3-[5-hydroxy-2-(methoxycarbonyl)-3-pentylphenoxy]-4-methoxy-2-pentylbenzoic acid|6-hydroxy-3-(5-hydroxy-2-methoxycarbonyl-3-pentyl-phenoxy)-4-methoxy-2-pentyl-benzoic Acid|6-hydroxy-3-(5'-hydroxy-2'-methoxycarbonyl-3'-pentylphenoxy)-4-methoxy-2-pentylbenzoic acid
| Molecular Formula | C26H34O8 |
|---|---|
| Molecular Weight | 474.22537 g/mol |
| LogP | 7.5 |
| Topological Polar Surface Area | 123.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 14 |
| Exact Mass | 474.22537 |
| Monoisotopic Mass | 474.22537 |
| Heavy Atoms | 34 |
| Complexity | 626.0 |
Chemical Identifiers
| CAS Number | 101910-69-4 |
|---|---|
| SMILES | CCCCCC1=C(C(=CC(=C1)O)OC2=C(C=C(C(=C2CCCCC)C(=O)O)O)OC)C(=O)OC |
| InChIKey | FVGIGMWEANQQSW-UHFFFAOYSA-N |
Product Overview
Epiphorellic acid 1 (CAS 101910-69-4), with molecular formula C26H34O8 and molecular weight 474.22537 g/mol. IUPAC: 6-hydroxy-3-(5-hydroxy-2-methoxycarbonyl-3-pentylphenoxy)-4-methoxy-2-pentylbenzoic acid.