Structure Database (LMSD)

Common Name
Deepoxyalchornoic acid
Systematic Name
14,15-dohidroxy-11Z-eicosenoic acid
Synonyms
LM ID
LMFA01050624
Formula
Exact Mass
Calculate m/z
342.277011
Sum Composition
Status
Curated

Classification

References

Taxonomy Information

Curated from
NCBI taxonomy class
Reference
Alchornea cordifolia (#316697)
Magnoliopsida (#3398)
Alchornoic acid derivatives from the fruits of Alchornea cordifolia (Schumach. & Thonn.) Muell. Arg. (Euphorbiaceae),
Phtyochem Letts, 2018

String Representations

InChiKey (Click to copy)
IPBVCWLWLMAWDE-RAXLEYEMSA-N
InChi (Click to copy)
InChI=1S/C20H38O4/c1-2-3-12-15-18(21)19(22)16-13-10-8-6-4-5-7-9-11-14-17-20(23)24/h10,13,18-19,21-22H,2-9,11-12,14-17H2,1H3,(H,23,24)/b13-10-
SMILES (Click to copy)
C(CCCCCCCCC/C=C\CC(O)C(O)CCCCC)(=O)O

Calculated Physicochemical Properties

Heavy Atoms 24
Rings
Aromatic Rings
Rotatable Bonds 17
Van der Waals Molecular Volume 384.44
Topological Polar Surface Area 77.76
Hydrogen Bond Donors 3
Hydrogen Bond Acceptors 4
logP 5.40
Molar Refractivity 100.13

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Created at
20th Oct 2026
Updated at
20th Oct 2026