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

Delta notation: ai-9:0

Other Names: (±)-6-Methyloctanoic acid; 6-Methylcaprylic acid; 6-Methyloctanoic acid; Anteisononanoic acid; ai-Nonanoic acid

Formula: C9 H18 O2

Mass: 158.24

Octanoic acid, 6 methyl
Structure drawn at OPSIN (opsin.ch.cam.uk)

External Database IDs:
CAS registry: 504-99-4
SOFA Mol: M_201
Lipid Maps: LMFA01020002
PubChem: 10447
ChEBI:

inchi: InChI=1/C9H18O2/c1-3-8(2)6-4-5-7-9(10)11/h8H,3-7H2,1-2H3,(H,10,11)/f/h10H

stdinchi: InChI=1S/C9H18O2/c1-3-8(2)6-4-5-7-9(10)11/h8H,3-7H2,1-2H3,(H,10,11)

stdinchikey: GPOPHQSTNHUENT-UHFFFAOYSA-N

smiles: CC(CCCCC(=O)O)CC


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