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(Q105291641)
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(14S)-14-methyl-1-(pyrrolidin-1-yl)hexadecan-1-one
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
14-methyl-1-(pyrrolidin-1-yl)hexadecan-1-one
1 reference
based on heuristic
inferred from SMILES
mass
323.318814932
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₁H₄₁NO
0 references
canonical SMILES
O=C(N1CCCC1)CCCCCCCCCCCCC(C)CC
0 references
isomeric SMILES
CC[C@H](C)CCCCCCCCCCCCC(=O)N1CCCC1
0 references
found in taxon
Distimake quinquefolius
1 reference
stated in
Chemotaxonomy of the pantropical genus Merremia (Convolvulaceae) based on the distribution of tropane alkaloids
Identifiers
InChI
InChI=1S/C21H41NO/c1-3-20(2)16-12-10-8-6-4-5-7-9-11-13-17-21(23)22-18-14-15-19-22/h20H,3-19H2,1-2H3/t20-/m0/s1
0 references
InChIKey
VRAFLAJRBDTYBS-FQEVSTJZSA-N
0 references
CAS Registry Number
260058-83-1
1 reference
stated in
CAS (formerly Chemical Abstracts Service)
retrieved
25 January 2022
PubChem CID
11163114
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
VRAFLAJRBDTYBS-FQEVSTJZSA-N
UniChem compound ID
33776176
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID001231882
1 reference
matched by identifier from
InChIKey
InChIKey
VRAFLAJRBDTYBS-FQEVSTJZSA-N
KNApSAcK ID
C00054018
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
VRAFLAJRBDTYBS-FQEVSTJZSA-N
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