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37Z

Summary
Name:sym-homospermidine
Formula:C8 H21 N3
Formal charge:0
Formula weight:159.272 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
ACDLabs12.01N-(4-aminobutyl)butane-1,4-diamine
OpenEye OEToolkits1.9.2N'-(4-azanylbutyl)butane-1,4-diamine

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs12.01NCCCCNCCCCN
InChIInChI1.03InChI=1S/C8H21N3/c9-5-1-3-7-11-8-4-2-6-10/h11H,1-10H2
InChIKeyInChI1.03UODZHRGDSPLRMD-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.385NCCCCNCCCCN
SMILESCACTVS3.385NCCCCNCCCCN
SMILES_CANONICALOpenEye OEToolkits1.9.2C(CCNCCCCN)CN
SMILESOpenEye OEToolkits1.9.2C(CCNCCCCN)CN

218853

PDB entries from 2024-04-24

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