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DCL

Summary
Name:2-AMINO-4-METHYL-PENTAN-1-OL
Synonyms:LEUCINOL
Formula:C6 H15 N O
Formal charge:0
Formula weight:117.189 Da
Component type:peptide-like

Chemical Identifiers

ProgramVersionName
ACDLabs12.01(2S)-2-amino-4-methylpentan-1-ol
OpenEye OEToolkits1.7.2(2S)-2-azanyl-4-methyl-pentan-1-ol

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs12.01OCC(N)CC(C)C
InChIInChI1.03InChI=1S/C6H15NO/c1-5(2)3-6(7)4-8/h5-6,8H,3-4,7H2,1-2H3/t6-/m0/s1
InChIKeyInChI1.03VPSSPAXIFBTOHY-LURJTMIESA-N
SMILES_CANONICALCACTVS3.370CC(C)C[C@H](N)CO
SMILESCACTVS3.370CC(C)C[CH](N)CO
SMILES_CANONICALOpenEye OEToolkits1.7.2CC(C)C[C@@H](CO)N
SMILESOpenEye OEToolkits1.7.2CC(C)CC(CO)N

222624

PDB entries from 2024-07-17

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