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(Q82102816)
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English
heneicosane, 2-methyl
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 aliphatic hydrocarbon
0 references
mass
310.359951472
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₂H₄₆
0 references
canonical SMILES
CCCCCCCCCCCCCCCCCCCC(C)C
0 references
found in taxon
Hamamelis virginiana
1 reference
stated in
Study on the composition of the volatile fraction of Hamamelis virginiana
Identifiers
InChI
InChI=1S/C22H46/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22(2)3/h22H,4-21H2,1-3H3
0 references
InChIKey
JQMPJOXNMWUULP-UHFFFAOYSA-N
0 references
CAS Registry Number
1560-82-3
0 references
PubChem CID
528494
1 reference
matched by identifier from
InChIKey
InChIKey
JQMPJOXNMWUULP-UHFFFAOYSA-N
ChEBI ID
185139
mapping relation type
exact match
2 references
stated in
ChEBI release 2022-06-13
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C22H46/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22(2)3/h22H,4-21H2,1-3H3
UniChem compound ID
25497906
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID90336027
1 reference
matched by identifier from
InChIKey
InChIKey
JQMPJOXNMWUULP-UHFFFAOYSA-N
DSSTOX compound identifier
DTXCID40287116
0 references
Human Metabolome Database ID
HMDB0032678
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
JQMPJOXNMWUULP-UHFFFAOYSA-N
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