Basic information
- CAS
101467-70-3- Standard SMILES
O=c1c(Cc2ccc(O)cc2)coc2cc(O)cc(O)c12- InChIKey
STWLHRJLBIXUSE-UHFFFAOYSA-N- Molecular formula
- C16H12O5
- Average molar mass
- 284.26 g/mol
- Monoisotopic mass
- 284.06847348
Overview
5,7-Dihydroxy-3-[(4-hydroxyphenyl)methyl]-4H-1-benzopyran-4-one has been reported in Dracaena draco with data available.
Names & identifiers
- Preferred name
- 5,7-Dihydroxy-3-((4-hydroxyphenyl)methyl)-4H-1-benzopyran-4-one
- IUPAC
- 5,7-dihydroxy-3-[(4-hydroxyphenyl)methyl]chromen-4-one
Names & synonyms
101467-70-3DTXSID204692915,7-Dihydroxy-3-[(4-hydroxyphenyl)methyl]-4H-1-benzopyran-4-one5,7-Dihydroxy-3-((4-hydroxyphenyl)methyl)-4H-1-benzopyran-4-oneRefChem:298847DTXCID704201105,7-dihydroxy-3-[(4-hydroxyphenyl)methyl]-4H-chromen-4-one5,7-Dihydroxy-3-(4-hydroxybenzyl)-4H-chromen-4-one4H-1-Benzopyran-4-one, 5,7-dihydroxy-3-[(4-hydroxyphenyl)methyl]-SCHEMBL286283415,7-dihydroxy-3-(4'-hydroxybenzyl) chromone
Database identifiers
- CAS
101467-70-3- PubChem CID
- 11601633
- DTXSID
DTXSID20469291- Nikkaji
- J2.270.354D
Properties
Computed structural properties
- XLogP
- 3
- Topological polar surface area
- 87 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 2
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 424
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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