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

ONW

Summary
Name:(2~{R})-1-[(2~{R})-1-(2-methoxyethoxy)propan-2-yl]oxypropan-2-amine
Synonyms:Jeffamine
Formula:C9 H21 N O3
Formal charge:0
Formula weight:191.268 Da
Component type:non-polymer

Chemical Identifiers

ProgramVersionName
OpenEye OEToolkits2.0.7(2~{R})-1-[(2~{R})-1-(2-methoxyethoxy)propan-2-yl]oxypropan-2-amine

Chemical Descriptors

TypeProgramVersionDescriptor
InChIInChI1.03InChI=1S/C9H21NO3/c1-8(10)6-13-9(2)7-12-5-4-11-3/h8-9H,4-7,10H2,1-3H3/t8-,9-/m1/s1
InChIKeyInChI1.03JKCPHDAMWZLSSR-RKDXNWHRSA-N
SMILES_CANONICALCACTVS3.385COCCOC[C@@H](C)OC[C@@H](C)N
SMILESCACTVS3.385COCCOC[CH](C)OC[CH](C)N
SMILES_CANONICALOpenEye OEToolkits2.0.7C[C@H](CO[C@H](C)COCCOC)N
SMILESOpenEye OEToolkits2.0.7CC(COC(C)COCCOC)N

219869

PDB entries from 2024-05-15

PDB statisticsPDBj update infoContact PDBjnumon