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GC7

Summary
Name:1-GUANIDINIUM-7-AMINOHEPTANE
Formula:C8 H22 N4
Formal charge:0
Formula weight:174.287 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
ACDLabs10.04N-(7-aminoheptyl)methanetriamine
OpenEye OEToolkits1.5.0N-(7-aminoheptyl)methanetriamine

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs10.04NC(N)NCCCCCCCN
SMILES_CANONICALCACTVS3.341NCCCCCCCNC(N)N
SMILESCACTVS3.341NCCCCCCCNC(N)N
SMILES_CANONICALOpenEye OEToolkits1.5.0C(CCCN)CCCNC(N)N
SMILESOpenEye OEToolkits1.5.0C(CCCN)CCCNC(N)N
InChIInChI1.03InChI=1S/C8H22N4/c9-6-4-2-1-3-5-7-12-8(10)11/h8,12H,1-7,9-11H2
InChIKeyInChI1.03SKGAVCHIFDRDTK-UHFFFAOYSA-N

219515

PDB entries from 2024-05-08

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