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(Q82224476)
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9-methyldecanoic acid
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
fatty acid
0 references
mass
186.161979944
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₁H₂₂O₂
0 references
canonical SMILES
CC(C)CCCCCCCC(=O)O
0 references
found in taxon
Solanum pennellii
1 reference
stated in
Acylsugars of the wild tomato Lycopersicon pennellii in relation to geographic distribution of the species
Identifiers
InChI
InChI=1S/C11H22O2/c1-10(2)8-6-4-3-5-7-9-11(12)13/h10H,3-9H2,1-2H3,(H,12,13)
0 references
InChIKey
VSAJTRPXXNCHGB-UHFFFAOYSA-N
0 references
CAS Registry Number
1119-63-7
1 reference
InChIKey
VSAJTRPXXNCHGB-UHFFFAOYSA-N
stated in
CAS Common Chemistry
retrieved
10 April 2021
reference URL
https://commonchemistry.cas.org/detail?cas_rn=1119-63-7
PubChem CID
5312289
1 reference
matched by identifier from
InChIKey
InChIKey
VSAJTRPXXNCHGB-UHFFFAOYSA-N
ChEBI ID
179374
mapping relation type
exact match
2 references
stated in
ChEBI release 2022-06-13
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C11H22O2/c1-10(2)8-6-4-3-5-7-9-11(12)13/h10H,3-9H2,1-2H3,(H,12,13)
SureChEMBL ID
SCHEMBL839420
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
VSAJTRPXXNCHGB-UHFFFAOYSA-N
UniChem compound ID
25875033
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID30415547
1 reference
matched by identifier from
InChIKey
InChIKey
VSAJTRPXXNCHGB-UHFFFAOYSA-N
DSSTOX compound identifier
DTXCID00208009
0 references
Human Metabolome Database ID
HMDB0034456
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
VSAJTRPXXNCHGB-UHFFFAOYSA-N
UNII
DBV7VPE72X
1 reference
matched by identifier from
InChIKey
InChIKey
VSAJTRPXXNCHGB-UHFFFAOYSA-N
LIPID MAPS ID
LMFA01020188
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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