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(Q82103115)
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2-Heneicosanone
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 ketone
0 references
mass
310.323565964
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₁H₄₂O
0 references
canonical SMILES
CCCCCCCCCCCCCCCCCCCC(=O)C
0 references
found in taxon
Festuca hieronymi
1 reference
stated in
Festuca argentina and Festuca hieronymi : Chemical relationships between non-polar constituents
Hamamelis virginiana
1 reference
stated in
Study on the composition of the volatile fraction of Hamamelis virginiana
Cynomorium songaricum
1 reference
stated in
GC-MS analysis of liposoluble constituents from the stems of Cynomorium songaricum
Commelina undulata
1 reference
stated in
A dammarane triterpene from Commelina undulata
Identifiers
InChI
InChI=1S/C21H42O/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21(2)22/h3-20H2,1-2H3
0 references
InChIKey
VUVUIDMZOWHIIJ-UHFFFAOYSA-N
0 references
CAS Registry Number
22589-04-4
0 references
PubChem CID
529805
1 reference
matched by identifier from
InChIKey
InChIKey
VUVUIDMZOWHIIJ-UHFFFAOYSA-N
ChEBI ID
179411
mapping relation type
exact match
2 references
stated in
ChEBI release 2022-06-13
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C21H42O/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21(2)22/h3-20H2,1-2H3
UniChem compound ID
26382853
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID50336189
1 reference
matched by identifier from
InChIKey
InChIKey
VUVUIDMZOWHIIJ-UHFFFAOYSA-N
DSSTOX compound identifier
DTXCID00287278
0 references
LIPID MAPS ID
LMFA12000220
1 reference
stated in
LIPID MAPS
reference URL
http://www.lipidmaps.org/rest/compound/lm_id/LM/all/download
retrieved
30 June 2018
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