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English
2-Aminostrychnidin-10-one
group of stereoisomers with the chemical formula C₂₁H₂₃N₃O₂
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Statements
instance of
group of stereoisomers
0 references
subclass of
chemical compound
0 references
mass
349.17902697600005
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₁H₂₃N₃O₂
1 reference
based on heuristic
inferred from SMILES
canonical SMILES
Nc1ccc2c(c1)C13CCN4CC5=CCOC6CC(=O)N2C1C6C5CC43
1 reference
based on heuristic
inferred from isomeric SMILES
isomeric SMILES
Nc1ccc2c(c1)[C@@]13CCN4CC5=CCOC6CC(=O)N2C1[C@H]6[C@H]5C[C@H]43
1 reference
based on heuristic
inferred from InChI
Identifiers
InChI
InChI=1S/C21H23N3O2/c22-12-1-2-15-14(7-12)21-4-5-23-10-11-3-6-26-16-9-18(25)24(15)20(21)19(16)13(11)8-17(21)23/h1-3,7,13,16-17,19-20H,4-6,8-10,22H2/t13-,16?,17-,19-,20?,21+/m0/s1
0 references
InChIKey
NRGHCWQGTHPFTE-XBPPHNHDSA-N
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CAS Registry Number
3215-24-5
0 references
PubChem CID
102382
1 reference
stated in
PubChem
retrieved
26 December 2021
inferred from
InChIKey
UniChem compound ID
48216469
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID30954007
0 references
DSSTOX compound identifier
DTXCID701382042
0 references
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zhwiki
2-氨基番木鳖碱
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