(2S)-2-[[(2S,3R)-2-azaniumyl-3-oxidanyl-butanoyl]amino]-5-azanyl-5-oxidanylidene-pentanoate

Systemtic Name: (2S)-2-[[(2S,3R)-2-azaniumyl-3-oxidanyl-butanoyl]amino]-5-azanyl-5-oxidanylidene-pentanoate Openeye Name: (2S)-5-amino-2-[[(2S,3R)-2-azaniumyl-3-hydroxy-butanoyl]amino]-5-oxo-pentanoate CAS Name: (2S)-5-amino-2-[[(2S,3R)-2-ammonio-3-hydroxy-1-oxobutyl]amino]-5-oxopentanoate IUPAC Name: (2S)-5-amino-2-[[(2S,3R)-2-azaniumyl-3-hydroxybutanoyl]amino]-5-oxopentanoate Traditional Name: (2S)-5-amino-2-[[(2S,3R)-2-ammonio-3-hydroxy-butanoyl]amino]-5-keto-valerate Formula: C9H17N3O5 MolecularWeight: 247.24838

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C(=O)NC(CCC(=O)N)C(=O)[O-])[NH3+])O

Isomeric SMILES

C[C@H]([C@@H](C(=O)N[C@@H](CCC(=O)N)C(=O)[O-])[NH3+])O

InChI

InChI=1S/C9H17N3O5/c1-4(13)7(11)8(15)12-5(9(16)17)2-3-6(10)14/h4-5,7,13H,2-3,11H2,1H3,(H2,10,14)(H,12,15)(H,16,17)/t4-,5+,7+/m1/s1