Structure Database (LMSD)

Common Name
Rhamnetin
Systematic Name
3,5,3',4'-Tetrahydroxy-7-methoxyflavone
Synonyms
  • 7-Methoxyquercetin
LM ID
LMPK12112624
Formula
C16H12O7
Exact Mass
Calculate m/z
316.058305
Status
Active
Show lipids differing only in stereochemistry/bond geometry
View MassBank spectra

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)
JGUZGNYPMHHYRK-UHFFFAOYSA-N
InChi (Click to copy)
InChI=1S/C16H12O7/c1-22-8-5-11(19)13-12(6-8)23-16(15(21)14(13)20)7-2-3-9(17)10(18)4-7/h2-6,17-19,21H,1H3
SMILES (Click to copy)
C1(OC)=CC2OC(C3C=C(O)C(O)=CC=3)=C(O)C(=O)C=2C(O)=C1

Other Databases

Wikipedia
Rhamnetin
KEGG ID
C10176
HMDB ID
HMDB0133823
CHEBI ID
74992
METABOLOMICS ID
FL5FCCNS0001
PubChem CID
5281691
Cayman ID
20302
PDB ID
J8G

Calculated Physicochemical Properties

Heavy Atoms 23
Rings 3
Aromatic Rings 3
Rotatable Bonds 2
Van der Waals Molecular Volume 255.99
Topological Polar Surface Area 120.36
Hydrogen Bond Donors 4
Hydrogen Bond Acceptors 7
logP 3.19
Molar Refractivity 81.24

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Updated at
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