Structure database (LMSD)

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LM IDLMPK12160037
Common Name6,2'4'-Trihydroxy-2-phenylbenzofuran
Systematic Name2-(2,4-Dihydroxyphenyl)-6-hydroxybenzofuran
Synonyms-
Exact Mass
242.0579 (neutral)    Calculate m/z:
FormulaC14H10O4
CategoryPolyketides [PK]
Main ClassFlavonoids [PK12]
Sub ClassOther Flavonoids [PK1216]
PubChem CID15480861
METABOLOMICS IDFLII1ANS0002
InChIKeyGYHKMDWFVHCCRA-UHFFFAOYSA-N  Show lipids differing only in stereochemistry/bond geometry
InChIInChI=1S/C14H10O4/c15-9-3-4-11(12(17)6-9)14-5-8-1-2-10(16)7-13(8)18-14/h1-7,15-1
7H
SMILESC1(O)C=CC(C2OC3=CC(O)=CC=C3C=2)=C(O)C=1
StatusActive
Calculated physicochemical properties (?):
 Heavy Atoms18Rings3Aromatic Rings3Rotatable Bonds1
 van der Waals
Molecular Volume
197.66Topological Polar
Surface Area
73.83Hydrogen
Bond Donors
3Hydrogen
Bond Acceptors
4
 logP3.22Molar
Refractivity
66.64