G3M

(3S)-N~6~-carbamimidoyl-3-hydroxy-L-lysine

Created: 2018-05-03
Last modified:  2018-05-16

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Chemical Details

Formal Charge0
Atom Count30
Chiral Atom Count2
Bond Count29
Aromatic Bond Count0
2D diagram of G3M

Chemical Component Summary

Name(3S)-N~6~-carbamimidoyl-3-hydroxy-L-lysine
Systematic Name (OpenEye OEToolkits)(2~{S},3~{S})-2-azanyl-6-carbamimidamido-3-oxidanyl-hexanoic acid
FormulaC7 H16 N4 O3
Molecular Weight204.227
TypeL-PEPTIDE LINKING

Chemical Descriptors

TypeProgram Version Descriptor
SMILESACDLabs12.01O=C(O)C(C(O)CCCNC(=N)\N)N
SMILESCACTVS3.385N[CH]([CH](O)CCCNC(N)=N)C(O)=O
SMILESOpenEye OEToolkits2.0.6C(CC(C(C(=O)O)N)O)CNC(=N)N
Canonical SMILESCACTVS3.385 N[C@@H]([C@@H](O)CCCNC(N)=N)C(O)=O
Canonical SMILESOpenEye OEToolkits2.0.6 [H]/N=C(/N)\NCCC[C@@H]([C@@H](C(=O)O)N)O
InChIInChI1.03 InChI=1S/C7H16N4O3/c8-5(6(13)14)4(12)2-1-3-11-7(9)10/h4-5,12H,1-3,8H2,(H,13,14)(H4,9,10,11)/t4-,5-/m0/s1
InChIKeyInChI1.03 ZMNNJGSTNCXCMN-WHFBIAKZSA-N

Related Resource References

Resource NameReference
PubChem 133084109