2-azanyl-5-oxidanylidene-5-[1-oxidanyl-3-[(E)-4-oxidanyl-4-oxidanylidene-but-2-enoyl]oxy-propan-2-yl]oxy-pentanoic acid

Systemtic Name: 2-azanyl-5-oxidanylidene-5-[1-oxidanyl-3-[(E)-4-oxidanyl-4-oxidanylidene-but-2-enoyl]oxy-propan-2-yl]oxy-pentanoic acid Openeye Name: 2-amino-5-[1-(hydroxymethyl)-2-[(E)-4-hydroxy-4-oxo-but-2-enoyl]oxy-ethoxy]-5-oxo-pentanoic acid CAS Name: 2-amino-5-[1-hydroxy-3-[(E)-4-hydroxy-1,4-dioxobut-2-enoxy]propan-2-yl]oxy-5-oxopentanoic acid IUPAC Name: 2-amino-5-[1-hydroxy-3-[(E)-4-hydroxy-4-oxobut-2-enoyl]oxypropan-2-yl]oxy-5-oxopentanoic acid Traditional Name: 2-amino-5-[2-hydroxy-1-[[(E)-4-hydroxy-4-keto-but-2-enoyl]oxymethyl]ethoxy]-5-keto-valeric acid Formula: C12H17NO9 MolecularWeight: 319.26468

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Descriptors Computed from Structure

Canonical SMILES:

C(CC(=O)OC(CO)COC(=O)C=CC(=O)O)C(C(=O)O)N

Isomeric SMILES

C(CC(=O)OC(CO)COC(=O)/C=C/C(=O)O)C(C(=O)O)N

InChI

InChI=1S/C12H17NO9/c13-8(12(19)20)1-3-11(18)22-7(5-14)6-21-10(17)4-2-9(15)16/h2,4,7-8,14H,1,3,5-6,13H2,(H,15,16)(H,19,20)/b4-2+