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(Q82638578)
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English
Propyl octadeca-9,12-dienoate
chemical compound
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No label defined
No description defined
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Statements
instance of
type of chemical entity
0 references
subclass of
biogenic acyclic ester
0 references
mass
322.287180456
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₁H₃₈O₂
0 references
canonical SMILES
O=C(OCCC)CCCCCCCC=CCC=CCCCCC
0 references
found in taxon
maize
1 reference
stated in
Fatty Acidn-Propyl and Ethyl Esters in the Volatile Oil from Dentcorn,Zea maysL. var.indentata, Silage
Identifiers
InChI
InChI=1S/C21H38O2/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-21(22)23-20-4-2/h8-9,11-12H,3-7,10,13-20H2,1-2H3
0 references
InChIKey
AJAMRCUNWLZBDF-UHFFFAOYSA-N
0 references
CAS Registry Number
38433-95-3
0 references
PubChem CID
53645533
2 references
stated in
PubChem
retrieved
26 December 2021
inferred from
InChIKey
matched by identifier from
InChIKey
InChIKey
AJAMRCUNWLZBDF-UHFFFAOYSA-N
UniChem compound ID
25656700
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID10705635
1 reference
matched by identifier from
InChIKey
InChIKey
AJAMRCUNWLZBDF-UHFFFAOYSA-N
DSSTOX compound identifier
DTXCID40656383
0 references
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