Structure Database (LMSD)

Common Name
6-Hydroxygalangin
Systematic Name
Synonyms
LM ID
LMPK12112802
Formula
C15H10O6
Exact Mass
Calculate m/z
286.04774
Status
Curated
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)
SDILYIBSLKZODH-UHFFFAOYSA-N
InChi (Click to copy)
InChI=1S/C15H10O6/c16-8-6-9-10(12(18)11(8)17)13(19)14(20)15(21-9)7-4-2-1-3-5-7/h1-6,16-18,20H
SMILES (Click to copy)
C1(O)=CC2OC(C3C=CC=CC=3)=C(O)C(=O)C=2C(O)=C1O

Other Databases

HMDB ID
HMDB0125367
METABOLOMICS ID
FL5FE9NS0001
PubChem CID
15233950

Calculated Physicochemical Properties

Heavy Atoms 21
Rings 3
Aromatic Rings 3
Rotatable Bonds 1
Van der Waals Molecular Volume 229.90
Topological Polar Surface Area 111.13
Hydrogen Bond Donors 4
Hydrogen Bond Acceptors 6
logP 3.18
Molar Refractivity 74.69

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