7QK

N~6~-acetyl-N~6~-methyl-L-lysine

Created:2021-08-17
Last modified:  2024-09-27

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Chemical Details

Formal Charge0
Atom Count32
Chiral Atom Count1
Bond Count31
Aromatic Bond Count0
2D diagram of 7QK

Chemical Component Summary

NameN~6~-acetyl-N~6~-methyl-L-lysine
Systematic Name (OpenEye OEToolkits)(2~{S})-2-azanyl-6-[ethanoyl(methyl)amino]hexanoic acid
FormulaC9 H18 N2 O3
Molecular Weight202.251
TypeL-PEPTIDE LINKING

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs12.01NC(CCCCN(C)C(C)=O)C(=O)O
SMILESCACTVS3.385CN(CCCC[CH](N)C(O)=O)C(C)=O
SMILESOpenEye OEToolkits2.0.7CC(=O)N(C)CCCCC(C(=O)O)N
Canonical SMILESCACTVS3.385 CN(CCCC[C@H](N)C(O)=O)C(C)=O
Canonical SMILESOpenEye OEToolkits2.0.7 CC(=O)N(C)CCCC[C@@H](C(=O)O)N
InChIInChI1.03 InChI=1S/C9H18N2O3/c1-7(12)11(2)6-4-3-5-8(10)9(13)14/h8H,3-6,10H2,1-2H3,(H,13,14)/t8-/m0/s1
InChIKeyInChI1.03 JDOAXXVMDRGGTF-QMMMGPOBSA-N

Related Resource References

Resource NameReference
PubChem 168451628