Structure via PubChem · Public domain (PubChem)
Chemical data
- Formula
- C16H14O6
- Molecular weight
- 302.28 g/mol
- IUPAC name
- (3R)-6,8-dihydroxy-3-(3-hydroxy-4-methoxyphenyl)-3,4-dihydroisochromen-1-one
- SMILES
- COC1=C(C=C(C=C1)[C@H]2CC3=C(C(=CC(=C3)O)O)C(=O)O2)O
- InChIKey
- MZKMQBPFGDJUFV-CQSZACIVSA-N
- XLogP
- 2.8
- Polar surface area
- 96.2 Ų
- H-bond donors
- 3
- H-bond acceptors
- 6
- Formal charge
- 0
via PubChem
Drug data · ChEMBL
- Molecule type
- Small molecule
via ChEMBL · EBI
Wikidata facts
- Mass
- 302.079038
Show 4 more facts
- canonical SMILES
- COC1=C(C=C(C=C1)C2CC3=CC(=CC(=C3C(=O)O2)O)O)O
- chemical formula
- C₁₆H₁₄O₆
- isomeric SMILES
- COC1=C(C=C(C=C1)[C@H]2CC3=CC(=CC(=C3C(=O)O2)O)O)O
- found in taxon
- Hydrangea serrata
Sources (2)
via Wikidata · CC0