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LOW

Summary
Name:(5~{S},7~{R})-3-azanyladamantan-1-ol
Formula:C10 H17 N O
Formal charge:0
Formula weight:167.248 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
OpenEye OEToolkits2.0.7(5~{S},7~{R})-3-azanyladamantan-1-ol

Chemical Descriptors

TypeProgramVersionDescriptor
InChIInChI1.03InChI=1S/C10H17NO/c11-9-2-7-1-8(3-9)5-10(12,4-7)6-9/h7-8,12H,1-6,11H2/t7-,8+,9+,10-
InChIKeyInChI1.03DWPIPTNBOVJYAD-FIRGSJFUSA-N
SMILES_CANONICALCACTVS3.385NC12C[C@@H]3C[C@H](C1)CC(O)(C3)C2
SMILESCACTVS3.385NC12C[CH]3C[CH](C1)CC(O)(C3)C2
SMILES_CANONICALOpenEye OEToolkits2.0.7C1[C@@H]2CC3(C[C@H]1CC(C2)(C3)O)N
SMILESOpenEye OEToolkits2.0.7C1C2CC3(CC1CC(C2)(C3)O)N

222624

PDB entries from 2024-07-17

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