Structure database (LMSD)

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LM IDLMPK12112498
Common NameSyringetin (W)
Systematic Name-
Synonyms-
Exact Mass
346.0689 (neutral)    Calculate m/z:
FormulaC17H14O8
CategoryPolyketides [PK]
Main ClassFlavonoids [PK12]
Sub ClassFlavones and Flavonols [PK1211]
PubChem CID5281953
METABOLOMICS IDFL5FAINS0001
KEGG IDC11620
CHEBI ID18215
InChIKeyUZMAPBJVXOGOFT-UHFFFAOYSA-N  Show lipids differing only in stereochemistry/bond geometry
InChI
InChI=1S/C17H14O8/c1-23-11-3-7(4-12(24-2)14(11)20)17-16(22)15(21)13-9(19)5-8(18)6-10(13)25-17/h3-6,18-20,22H,1-2H3
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SMILES
C1(O)=CC2OC(C3C=C(OC)C(O)=C(OC)C=3)=C(O)C(=O)C=2C(O)=C1
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StatusActive
Calculated physicochemical properties (?):
 Heavy Atoms25Rings3Aromatic Rings3Rotatable Bonds3
 van der Waals
Molecular Volume
282.08Topological Polar
Surface Area
129.59Hydrogen
Bond Donors
4Hydrogen
Bond Acceptors
8
 logP3.20Molar
Refractivity
87.79