Structure Database (LMSD)

Common Name
Syringetin
Systematic Name
Synonyms
LM ID
LMPK12112498
Formula
C17H14O8
Exact Mass
Calculate m/z
346.06887
Status
Active
Show lipids differing only in stereochemistry/bond geometry

Classification

Category
Main Class
Sub Class
Polyketides [PK]
Flavonoids [PK12]
Flavones and Flavonols [PK1211]

References

Taxonomy Information

Curated from
NCBI taxonomy class
Reference
Viridiplantae (#33090)
Flavonoid imported from http://metabolomics.jp/

String Representations

InChiKey (Click to copy)
UZMAPBJVXOGOFT-UHFFFAOYSA-N
InChi (Click to copy)
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
SMILES (Click to copy)
C1(O)=CC2OC(C3C=C(OC)C(O)=C(OC)C=3)=C(O)C(=O)C=2C(O)=C1

Other Databases

Wikipedia
Syringetin
KEGG ID
C11620
CHEBI ID
18215
METABOLOMICS ID
FL5FAINS0001
PubChem CID
5281953
Cayman ID
39249

Calculated Physicochemical Properties

Heavy Atoms 25
Rings 3
Aromatic Rings 3
Rotatable Bonds 3
Van der Waals Molecular Volume 282.08
Topological Polar Surface Area 129.59
Hydrogen Bond Donors 4
Hydrogen Bond Acceptors 8
logP 3.20
Molar Refractivity 87.79

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Updated at
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