LIPID MAPS

Structure Database (LMSD)

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Common Name

Acutifolin F

Systematic Name

8-(2-hydroxyethyl)-2-(4-hydroxyphenyl)-3,4-dihydro-2H-chromen-7-ol

Synonyms

LM ID

LMPK12020295

Formula

C₁₇H₁₈O₄

Exact Mass

Calculate m/z

286.12051

Status

Curated

Show lipids differing only in stereochemistry/bond geometry

Classification

References

Taxonomy Information

Curated from

NCBI taxonomy class

Reference

Brosimum acutifolium (#1835378)

Magnoliopsida (#3398)

Acutifolins A-F, a new flavan-derived constituent and five new flavans from Brosimum acutifolium.,
J Nat Prod, 2001

Pubmed ID: 11754597

String Representations

InChiKey (Click to copy)

IYBCLDNCTNLTDC-UHFFFAOYSA-N

InChi (Click to copy)

InChI=1S/C17H18O4/c18-10-9-14-15(20)7-3-12-4-8-16(21-17(12)14)11-1-5-13(19)6-2-11/h1-3,5-7,16,18-20H,4,8-10H2

SMILES (Click to copy)

C1(CCO)=C(O)C=CC2CCC(C3=CC=C(O)C=C3)OC1=2

Other Databases

PubChem CID

11748139

Calculated Physicochemical Properties

Heavy Atoms 21

Rings 3

Aromatic Rings 2

Rotatable Bonds 3

Van der Waals Molecular Volume 263.10

Topological Polar Surface Area 71.99

Hydrogen Bond Donors 3

Hydrogen Bond Acceptors 4

logP 2.98

Molar Refractivity 79.18

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Created at

2nd May 2025

Updated at