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SYG

Summary
Name:2-[(1~{S})-1-azanylpropyl]phenol
Formula:C9 H13 N O
Formal charge:0
Formula weight:151.206 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
OpenEye OEToolkits2.0.62-[(1~{S})-1-azanylpropyl]phenol

Chemical Descriptors

TypeProgramVersionDescriptor
InChIInChI1.03InChI=1S/C9H13NO/c1-2-8(10)7-5-3-4-6-9(7)11/h3-6,8,11H,2,10H2,1H3/t8-/m0/s1
InChIKeyInChI1.03SJYRIEHMQRIBEN-QMMMGPOBSA-N
SMILES_CANONICALCACTVS3.385CC[C@H](N)c1ccccc1O
SMILESCACTVS3.385CC[CH](N)c1ccccc1O
SMILES_CANONICALOpenEye OEToolkits2.0.6CC[C@@H](c1ccccc1O)N
SMILESOpenEye OEToolkits2.0.6CCC(c1ccccc1O)N

223166

PDB entries from 2024-07-31

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