LIPID MAPS

Structure Database (LMSD)

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Common Name

Velloquercetin 3,3',4'-trimethyl ether

Systematic Name

5-Hydroxy-3,3',4'-trimethoxy-5"-isopropenyl-4",5"-dihydrofurano[2,3:7,6]flavone

Synonyms

LM ID

LMPK12112766

Formula

C₂₃H₂₂O₇

Exact Mass

Calculate m/z

410.136555

Status

Curated

Show lipids differing only in stereochemistry/bond geometry

No other lipid differing only in stereochemistry/bond geometry found

View NP-MRD ID(NMR) spectrum

Classification

References

Taxonomy Information

Curated from

NCBI taxonomy class

Reference

Viridiplantae (#33090)

Flavonoid imported from http://metabolomics.jp/

Vellozia (#16383)

Magnoliopsida (#3398)

Six dihydrofuranoflavonols from the leaf surface ofVellozia,
Phytochemistry, 1992

DOI: 10.1016/0031-9422(91)83059-T

String Representations

InChiKey (Click to copy)

DOLRPGHVVKBWMY-UHFFFAOYSA-N

InChi (Click to copy)

InChI=1S/C23H22O7/c1-11(2)15-9-13-16(29-15)10-18-19(20(13)24)21(25)23(28-5)22(30-18)12-6-7-14(26-3)17(8-12)27-4/h6-8,10,15,24H,1,9H2,2-5H3

SMILES (Click to copy)

C12OC(C(=C)C)CC1=C(O)C1C(=O)C(OC)=C(C3C=C(OC)C(OC)=CC=3)OC=1C=2

Other Databases

METABOLOMICS ID

FL5FDFNF0001

PubChem CID

15126641

Calculated Physicochemical Properties

Heavy Atoms 30

Rings 4

Aromatic Rings 3

Rotatable Bonds 5

Van der Waals Molecular Volume 362.09

Topological Polar Surface Area 89.43

Hydrogen Bond Donors 1

Hydrogen Bond Acceptors 7

logP 5.26

Molar Refractivity 112.79

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Created at

Updated at

15th Sep 2026