(2S)-6-phosphono-2-[[(2S)-2-(propanoylamino)propanoyl]amino]hexanoic acid

Systemtic Name: (2S)-6-phosphono-2-[[(2S)-2-(propanoylamino)propanoyl]amino]hexanoic acid Openeye Name: (2S)-6-phosphono-2-[[(2S)-2-(propanoylamino)propanoyl]amino]hexanoic acid CAS Name: (2S)-2-[[(2S)-1-oxo-2-(1-oxopropylamino)propyl]amino]-6-phosphonohexanoic acid IUPAC Name: (2S)-6-phosphono-2-[[(2S)-2-(propanoylamino)propanoyl]amino]hexanoic acid Traditional Name: (2S)-6-phosphono-2-[[(2S)-2-propionamidopropanoyl]amino]hexanoic acid Formula: C12H23N2O7P MolecularWeight: 338.293981

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC(C)C(=O)NC(CCCCP(=O)(O)O)C(=O)O

Isomeric SMILES

CCC(=O)N[C@@H](C)C(=O)N[C@@H](CCCCP(=O)(O)O)C(=O)O

InChI

InChI=1S/C12H23N2O7P/c1-3-10(15)13-8(2)11(16)14-9(12(17)18)6-4-5-7-22(19,20)21/h8-9H,3-7H2,1-2H3,(H,13,15)(H,14,16)(H,17,18)(H2,19,20,21)/t8-,9-/m0/s1