Structure Database (LMSD)

Common Name
Norwogonin
Systematic Name
Synonyms
LM ID
LMPK12111329
Formula
C15H10O5
Exact Mass
Calculate m/z
270.052825
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)
ZFKKRRMUPBBYRS-UHFFFAOYSA-N
InChi (Click to copy)
InChI=1S/C15H10O5/c16-9-6-11(18)14(19)15-13(9)10(17)7-12(20-15)8-4-2-1-3-5-8/h1-7,16,18-19H
SMILES (Click to copy)
C1(O)=C(O)C2OC(C3C=CC=CC=3)=CC(=O)C=2C(O)=C1

Other Databases

KEGG ID
C10113
HMDB ID
HMDB0130170
CHEBI ID
7642
METABOLOMICS ID
FL3FF9NS0001
PubChem CID
5281674
Cayman ID
29227

Calculated Physicochemical Properties

Heavy Atoms 20
Rings 3
Aromatic Rings 3
Rotatable Bonds 1
Van der Waals Molecular Volume 221.11
Topological Polar Surface Area 90.90
Hydrogen Bond Donors 3
Hydrogen Bond Acceptors 5
logP 3.48
Molar Refractivity 73.02

Admin

Created at
-
Updated at
-