Structure via PubChem · Public domain (PubChem)
7-methoxycoumarin
Sign in to saveAlso known as 7-methoxy-2H-1-benzopyran-2-one, methylumbelliferone, herniarine, ayapanin, herniarin
Herniarin is a natural chemical compound. Chemically, it can be considered a methoxy derivative of coumarin or a methyl derivative of umbelliferone.
Chemical data
- Formula
- C10H8O3
- Molecular weight
- 176.17 g/mol
- IUPAC name
- 7-methoxychromen-2-one
- SMILES
- COC1=CC2=C(C=C1)C=CC(=O)O2
- InChIKey
- LIIALPBMIOVAHH-UHFFFAOYSA-N
- XLogP
- 1.9
- Polar surface area
- 35.5 Ų
- H-bond donors
- 0
- H-bond acceptors
- 3
- Formal charge
- 0
via PubChem
Drug data · ChEMBL
- Molecule type
- Small molecule
via ChEMBL · EBI
Wikidata facts
- Mass
- 176.047
Show 4 more facts
- found in taxon
- Ficus sagittata
- melting point
- 119.0
- chemical formula
- C₁₀H₈O₃
- canonical SMILES
- COC1=CC2=C(C=C1)C=CC(=O)O2
Sources (2)
via Wikidata · CC0
~1 min read
Encyclopedic overview
1 sectionsContents
- References
Herniarin is a natural chemical compound. Chemically, it can be considered a methoxy derivative of coumarin or a methyl derivative of umbelliferone.
Herniarin is found in Herniaria glabra, Ayapana triplinervis and in species of the genus Prunus (P. mahaleb, P. pensylvanica, and P. maximowiczii).
Excerpted from Wikipedia’s “7-methoxycoumarin” article, available under the CC BY-SA 4.0 licence.