LIPID MAPS

Structure Database (LMSD)

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Common Name

Apiferol

Systematic Name

(2S)-3,4-Dihydro-2-(4-hydroxyphenyl)-2H-1-benzopyran-4,5,7-triol

Synonyms

Apiforol
Leucoapigeninidin

LM ID

LMPK12020166

Formula

C₁₅H₁₄O₅

Exact Mass

Calculate m/z

274.084125

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/

Zea mays (#4577)

Magnoliopsida (#3398)

Genetic control of 3-hydroxy- and 3-deoxy- flavonoids in Zea mays,
Phytochemistry, 1975

DOI: 10.1016/0031-9422(75)85101-6

String Representations

InChiKey (Click to copy)

RPKUCYSGAXIESU-UHFFFAOYSA-N

InChi (Click to copy)

InChI=1S/C15H14O5/c16-9-3-1-8(2-4-9)13-7-12(19)15-11(18)5-10(17)6-14(15)20-13/h1-6,12-13,16-19H,7H2

SMILES (Click to copy)

C1(O)=CC2OC(C3C=CC(O)=CC=3)CC(O)C=2C(O)=C1

Other Databases

HMDB ID

HMDB0037232

METABOLOMICS ID

FL64AANS0001

PubChem CID

185795

Calculated Physicochemical Properties

Heavy Atoms 20

Rings 3

Aromatic Rings 2

Rotatable Bonds 1

Van der Waals Molecular Volume 237.29

Topological Polar Surface Area 92.22

Hydrogen Bond Donors 4

Hydrogen Bond Acceptors 5

logP 2.36

Molar Refractivity 70.82

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Created at

Updated at

2nd May 2025