(2S)-2-[2-[[(2S)-2-azanyl-5-oxidanyl-5-oxidanylidene-pentanoyl]amino]ethanoylamino]butanedioic acid

Systemtic Name: (2S)-2-[2-[[(2S)-2-azanyl-5-oxidanyl-5-oxidanylidene-pentanoyl]amino]ethanoylamino]butanedioic acid Openeye Name: (2S)-2-[[2-[[(2S)-2-amino-5-hydroxy-5-oxo-pentanoyl]amino]acetyl]amino]butanedioic acid CAS Name: (2S)-2-[[2-[[(2S)-2-amino-5-hydroxy-1,5-dioxopentyl]amino]-1-oxoethyl]amino]butanedioic acid IUPAC Name: (2S)-2-[[2-[[(2S)-2-amino-5-hydroxy-5-oxopentanoyl]amino]acetyl]amino]butanedioic acid Traditional Name: (2S)-2-[[2-[[(2S)-2-amino-5-hydroxy-5-keto-pentanoyl]amino]acetyl]amino]succinic acid Formula: C11H17N3O8 MolecularWeight: 319.26798

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Descriptors Computed from Structure

Canonical SMILES:

C(CC(=O)O)C(C(=O)NCC(=O)NC(CC(=O)O)C(=O)O)N

Isomeric SMILES

C(CC(=O)O)[C@@H](C(=O)NCC(=O)N[C@@H](CC(=O)O)C(=O)O)N

InChI

InChI=1S/C11H17N3O8/c12-5(1-2-8(16)17)10(20)13-4-7(15)14-6(11(21)22)3-9(18)19/h5-6H,1-4,12H2,(H,13,20)(H,14,15)(H,16,17)(H,18,19)(H,21,22)/t5-,6-/m0/s1