Structure database (LMSD)

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LM IDLMPK12040003
Common NameGinkgetin
Systematic Name-
SynonymsAmentoflavone 7,4'-dimethyl ether
Exact Mass
566.1213 (neutral)    Calculate m/z:
FormulaC32H22O10
CategoryPolyketides [PK]
Main ClassFlavonoids [PK12]
Sub ClassBiflavonoids and polyflavonoids [PK1204]
PubChem CID5271805
KEGG IDC10048
HMDB IDHMDB0033762
CHEBI ID5353
CAYMAN ID25103
InChIKeyAIFCFBUSLAEIBR-UHFFFAOYSA-N  Show lipids differing only in stereochemistry/bond geometry
InChI
InChI=1S/C32H22O10/c1-39-18-10-20(34)30-23(37)13-27(41-28(30)11-18)16-5-8-25(40-2)19(9-16)29-21(35)12-22(36)31-24(38)14-26(42-32(29)31)15-3-6-17(33)7-4-15/h3-14,33-36H,1-2H3
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SMILES
C1(OC)=CC2OC(C3C=CC(OC)=C(C4=C(O)C=C(O)C5C(=O)C=C(C6=CC=C(O)C=C6)OC4=5)C=3)=CC(=O)C=2C(O)=C1
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StatusActive
Calculated physicochemical properties (?):
 Heavy Atoms42Rings6Aromatic Rings6Rotatable Bonds5
 van der Waals
Molecular Volume
468.26Topological Polar
Surface Area
159.80Hydrogen
Bond Donors
4Hydrogen
Bond Acceptors
10
 logP7.54Molar
Refractivity
154.81