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Convolamine hydrochloride
No description defined
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
0 references
mass
341.13938592799997
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₇H₂₄ClNO₄
1 reference
based on heuristic
inferred from SMILES
canonical SMILES
COc1ccc(C(=O)OC2CC3CCC(C2)N3C)cc1OC.Cl
1 reference
based on heuristic
inferred from isomeric SMILES
isomeric SMILES
COc1ccc(C(=O)OC2C[C@H]3CC[C@@H](C2)N3C)cc1OC.Cl
1 reference
based on heuristic
inferred from InChI
Identifiers
InChI
InChI=1S/C17H23NO4.ClH/c1-18-12-5-6-13(18)10-14(9-12)22-17(19)11-4-7-15(20-2)16(8-11)21-3;/h4,7-8,12-14H,5-6,9-10H2,1-3H3;1H/t12-,13+,14?;
0 references
InChIKey
BGPGVBLFHMZCNG-LIWIJTDLSA-N
0 references
CAS Registry Number
5896-59-3
0 references
PubChem CID
6419899
1 reference
stated in
PubChem
retrieved
26 December 2021
inferred from
InChIKey
UniChem compound ID
56738203
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID60423559
0 references
DSSTOX compound identifier
DTXCID80374397
0 references
NSC number
123412
0 references
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