Structure Database (LMSD)

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

Classification

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

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

References

Taxonomy Information

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

Other Databases

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

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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