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English
N-[(2S)-1,3-Dihydroxyundecan-2-yl]benzamide
group of stereoisomers with the chemical formula C₁₈H₂₉NO₃
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Statements
instance of
group of stereoisomers
0 references
subclass of
chemical compound
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mass
307.214743788
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₈H₂₉NO₃
1 reference
based on heuristic
inferred from SMILES
canonical SMILES
CCCCCCCCC(O)C(CO)N=C(O)c1ccccc1
1 reference
based on heuristic
inferred from isomeric SMILES
isomeric SMILES
CCCCCCCCC(O)[C@H](CO)NC(=O)c1ccccc1
1 reference
based on heuristic
inferred from InChI
Identifiers
InChI
InChI=1S/C18H29NO3/c1-2-3-4-5-6-10-13-17(21)16(14-20)19-18(22)15-11-8-7-9-12-15/h7-9,11-12,16-17,20-21H,2-6,10,13-14H2,1H3,(H,19,22)/t16-,17?/m0/s1
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InChIKey
SJJVABMBSWENBR-BHWOMJMDSA-N
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CAS Registry Number
920277-54-9
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PubChem CID
44421766
1 reference
stated in
PubChem
retrieved
26 December 2021
inferred from
InChIKey
UniChem compound ID
482117
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID90658918
0 references
DSSTOX compound identifier
DTXCID90609667
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