LIPID MAPS

Structure Database (LMSD)

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Common Name

Farnesic acid

Systematic Name

3,7,11-trimethyl-2Z,6Z-dodecaenoic acid

Synonyms

Farnesenic acid
Farnesolic acid
Farnesylic acid

LM ID

LMFA01020400

Formula

C₂₅H₄₆O₂

Exact Mass

Calculate m/z

378.34978

Sum Composition

FA 25:2

Status

Active

Show lipids differing only in stereochemistry/bond geometry

Classification

String Representations

InChiKey (Click to copy)

BNQMYXIDUOKRHF-LGGASEKISA-N

InChi (Click to copy)

InChI=1S/C25H46O2/c1-5-6-7-8-9-10-11-12-13-16-22(2)17-14-18-23(3)19-15-20-24(4)21-25(26)27/h19,21-22H,5-18,20H2,1-4H3,(H,26,27)/b23-19-,24-21-

SMILES (Click to copy)

C(/C=C(/C)\CC/C=C(/C)\CCCC(C)CCCCCCCCCCC)(=O)O

Other Databases

PubChem CID

131839736

Calculated Physicochemical Properties

Heavy Atoms 27

Rings 0

Aromatic Rings 0

Rotatable Bonds 18

Van der Waals Molecular Volume 450.72

Topological Polar Surface Area 37.3

Hydrogen Bond Donors 1

Hydrogen Bond Acceptors 2

logP 8.47

Molar Refractivity 119.24

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