Structure Database (LMSD)

Systematic Name
3R,9-dimethyldecanoic acid
Synonyms
LM ID
LMFA01020460
Formula
Exact Mass
Calculate m/z
200.17763
Sum Composition
Status
Curated

Classification

References

Taxonomy Information

Curated from
NCBI taxonomy class
Reference
Felis catus (#9685)
Mammalia (#40674)
Signatures of branched-chain fatty acids derived from a kidney reservoir confer stable chemical individuality on domestic cats.,
Curr Biol, 2026
Pubmed ID: 42617604

String Representations

InChiKey (Click to copy)
XODDTZIDRCDBDI-LLVKDONJSA-N
InChi (Click to copy)
InChI=1S/C12H24O2/c1-10(2)7-5-4-6-8-11(3)9-12(13)14/h10-11H,4-9H2,1-3H3,(H,13,14)/t11-/m1/s1
SMILES (Click to copy)
C(C[C@H](C)CCCCCC(C)C)(=O)O

Calculated Physicochemical Properties

Heavy Atoms 14
Rings
Aromatic Rings
Rotatable Bonds 8
Van der Waals Molecular Volume 231.10
Topological Polar Surface Area 37.30
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 2
logP 3.70
Molar Refractivity 59.34

Admin

Created at
29th Sep 2026
Updated at
29th Sep 2026