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NLB

Summary
Name:6-(benzyloxy)-L-norleucine
Formula:C13 H19 N O3
Formal charge:0
Formula weight:237.295 Da
Component type:L-peptide linking

Chemical Identifiers

ProgramVersionName
ACDLabs12.016-(benzyloxy)-L-norleucine
OpenEye OEToolkits1.9.2(2S)-2-azanyl-6-phenylmethoxy-hexanoic acid

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs12.01O=C(O)C(N)CCCCOCc1ccccc1
InChIInChI1.03InChI=1S/C13H19NO3/c14-12(13(15)16)8-4-5-9-17-10-11-6-2-1-3-7-11/h1-3,6-7,12H,4-5,8-10,14H2,(H,15,16)/t12-/m0/s1
InChIKeyInChI1.03RPGCAWCHHYWJIF-LBPRGKRZSA-N
SMILES_CANONICALCACTVS3.385N[C@@H](CCCCOCc1ccccc1)C(O)=O
SMILESCACTVS3.385N[CH](CCCCOCc1ccccc1)C(O)=O
SMILES_CANONICALOpenEye OEToolkits1.9.2c1ccc(cc1)COCCCC[C@@H](C(=O)O)N
SMILESOpenEye OEToolkits1.9.2c1ccc(cc1)COCCCCC(C(=O)O)N

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PDB entries from 2024-07-17

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