Loading
PDBj
MenuPDBj@FacebookPDBj@TwitterPDBj@YouTubewwPDB FoundationwwPDB
RCSB PDBPDBeBMRBAdv. SearchSearch help

M3I

Summary
Name:5-methyl-1,2-oxazol-3-amine
Formula:C4 H6 N2 O
Formal charge:0
Formula weight:98.103 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
ACDLabs12.015-methyl-1,2-oxazol-3-amine
OpenEye OEToolkits1.7.05-methyl-1,2-oxazol-3-amine

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs12.01n1oc(cc1N)C
SMILES_CANONICALCACTVS3.370Cc1onc(N)c1
SMILESCACTVS3.370Cc1onc(N)c1
SMILES_CANONICALOpenEye OEToolkits1.7.0Cc1cc(no1)N
SMILESOpenEye OEToolkits1.7.0Cc1cc(no1)N
InChIInChI1.03InChI=1S/C4H6N2O/c1-3-2-4(5)6-7-3/h2H,1H3,(H2,5,6)
InChIKeyInChI1.03FKPXGNGUVSHWQQ-UHFFFAOYSA-N

227111

数据于2024-11-06公开中

PDB statisticsPDBj update infoContact PDBjnumon