(E,3S)-5-phosphono-3-(2-phosphonoethanoylamino)pent-4-enoic acid

Systemtic Name: (E,3S)-5-phosphono-3-(2-phosphonoethanoylamino)pent-4-enoic acid Openeye Name: (E,3S)-5-phosphono-3-[(2-phosphonoacetyl)amino]pent-4-enoic acid CAS Name: (E,3S)-3-[(1-oxo-2-phosphonoethyl)amino]-5-phosphono-4-pentenoic acid IUPAC Name: (E,3S)-5-phosphono-3-[(2-phosphonoacetyl)amino]pent-4-enoic acid Traditional Name: (E,3S)-5-phosphono-3-[(2-phosphonoacetyl)amino]pent-4-enoic acid Formula: C7H13NO9P2 MolecularWeight: 317.126942

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Descriptors Computed from Structure

Canonical SMILES:

C(C(C=CP(=O)(O)O)NC(=O)CP(=O)(O)O)C(=O)O

Isomeric SMILES

C([C@@H](/C=C/P(=O)(O)O)NC(=O)CP(=O)(O)O)C(=O)O

InChI

InChI=1S/C7H13NO9P2/c9-6(4-19(15,16)17)8-5(3-7(10)11)1-2-18(12,13)14/h1-2,5H,3-4H2,(H,8,9)(H,10,11)(H2,12,13,14)(H2,15,16,17)/b2-1+/t5-/m1/s1