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PubChem ID: 53445261
Acetic Acid;nonane-1,3-diol
Compound Details
Synonymous names
1,3-Nonanediol, 1-acetate
SCHEMBL1171378
DB-311483
Microorganism:
Yes
IUPAC name
acetic acid;nonane-1,3-diol
SMILES
CCCCCCC(CCO)O.CC(=O)O
Inchi
InChI=1S/C9H20O2.C2H4O2/c1-2-3-4-5-6-9(11)7-8-10;1-2(3)4/h9-11H,2-8H2,1H3;1H3,(H,3,4)
Formula
C
1
1
H
2
4
O
4
PubChem ID
53445261
Molweight
220.31
LogP
0
Atoms
15
Bonds
7
H-bond Acceptor
4
H-bond Donor
3
Chemical Classification
alcohols
carboxylic compounds
organic acids
mVOC Specific Details
Species emitting the compound
Kingdom
Species
Biological Function
Origin/Habitat
Reference
Lactobacillus Plantarum
Ma et al. 2023
Method
Kingdom
Species
Growth Medium
Applied Method
Verification
Lactobacillus Plantarum
tuna cooking liquid
HS-SPME-GC/MS
no