LIPID MAPS

Structure Database (LMSD)

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Common Name

Lucenin 1

Systematic Name

3',4',5,7-Tetrahydroxyflavone 6-C-xyloside-8-C-glucoside

Synonyms

Isocarlinoside
Luteolin-6-C-xyloside-8-C-glucoside

LM ID

LMPK12110486

Formula

C₂₆H₂₈O₁₅

Exact Mass

Calculate m/z

580.142826

Status

Curated

Show lipids differing only in stereochemistry/bond geometry

View NP-MRD ID(NMR) spectrum

Classification

References

Taxonomy Information

Curated from

NCBI taxonomy class

Reference

Viridiplantae (#33090)

Flavonoid imported from http://metabolomics.jp/

Vitex lucens (#384982)

Magnoliopsida (#3398)

A new type of glycoflavonoid from Vitex lucens,
Tetrahedron Letts, 1965

String Representations

InChiKey (Click to copy)

WYYFCTVKFALPQV-MCIQUCDDSA-N

InChi (Click to copy)

InChI=1S/C26H28O15/c27-5-13-18(33)21(36)23(38)26(41-13)16-20(35)15(25-22(37)17(32)11(31)6-39-25)19(34)14-10(30)4-12(40-24(14)16)7-1-2-8(28)9(29)3-7/h1-4,11,13,17-18,21-23,25-29,31-38H,5-6H2/t11-,13-,17+,18-,21+,22-,23-,25+,26+/m1/s1

SMILES (Click to copy)

C1(O)=C([C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)C2OC(C3C=CC(O)=C(O)C=3)=CC(=O)C=2C(O)=C1[C@H]1[C@H](O)[C@@H](O)[C@H](O)CO1

Other Databases

METABOLOMICS ID

FL3FACCS0018

PubChem CID

101316994

Calculated Physicochemical Properties

Heavy Atoms 41

Rings 5

Aromatic Rings 3

Rotatable Bonds 4

Van der Waals Molecular Volume 474.59

Topological Polar Surface Area 275.34

Hydrogen Bond Donors 11

Hydrogen Bond Acceptors 15

logP 1.43

Molar Refractivity 138.68

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Created at

Updated at

9th Nov 2026