LCZ

(2S)-2-amino-4-methylpentanal

Created: 2012-02-09
Last modified:  2012-08-31

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Chemical Details

Formal Charge0
Atom Count21
Chiral Atom Count1
Bond Count20
Aromatic Bond Count0
2D diagram of LCZ

Chemical Component Summary

Name(2S)-2-amino-4-methylpentanal
Systematic Name (OpenEye OEToolkits)(2S)-2-azanyl-4-methyl-pentanal
FormulaC6 H13 N O
Molecular Weight115.174
TypePEPTIDE-LIKE

Chemical Descriptors

TypeProgram Version Descriptor
SMILESACDLabs12.01O=CC(N)CC(C)C
SMILESCACTVS3.370CC(C)C[CH](N)C=O
SMILESOpenEye OEToolkits1.7.6CC(C)CC(C=O)N
Canonical SMILESCACTVS3.370 CC(C)C[C@H](N)C=O
Canonical SMILESOpenEye OEToolkits1.7.6 CC(C)C[C@@H](C=O)N
InChIInChI1.03 InChI=1S/C6H13NO/c1-5(2)3-6(7)4-8/h4-6H,3,7H2,1-2H3/t6-/m0/s1
InChIKeyInChI1.03 ZOFRRNUENOHELM-LURJTMIESA-N

Related Resource References

Resource NameReference
PubChem 133915