Exploring Phylogenetic Relationships between Hundreds of Plant Fatty Acids Synthesized by Thousands of Plants. more details ...

Delta notation: 6-COOH-6:0

Other Names: Duplicate; remove this Pimelic acid;Heptanedioic acid;Pileric acid;Heptandioic acid;1,5-Pentanedicarboxylic acid

Formula: C7H12O4

Mass: 160.07

IUPAC name: heptanedioic acid

Heptanedioic acid
Structure drawn at OPSIN (opsin.ch.cam.uk)

External Database IDs:
CAS registry: 111-16-0
SOFA Mol:
Lipid Maps: LMFA01170051
PubChem: 385
ChEBI: 30531

inchi: InChI=1S/C7H12O4/c8-6(9)4-2-1-3-5-7(10)11/h1-5H2,(H,8,9)(H,10,11)

stdinchi: InChI=1S/C7H12O4/c8-6(9)4-2-1-3-5-7(10)11/h1-5H2,(H,8,9)(H,10,11)

stdinchikey: WLJVNTCWHIRURA-UHFFFAOYSA-N

smiles: C(CCCCCC(=O)O)(=O)O


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