2-azanyl-6-[[(4R)-4-azanyl-5-oxidanyl-5-oxidanylidene-pentanoyl]amino]-4-methylidene-heptanedioic acid

Systemtic Name: 2-azanyl-6-[[(4R)-4-azanyl-5-oxidanyl-5-oxidanylidene-pentanoyl]amino]-4-methylidene-heptanedioic acid Openeye Name: 2-amino-6-[[(4R)-4-amino-5-hydroxy-5-oxo-pentanoyl]amino]-4-methylene-heptanedioic acid CAS Name: 2-amino-6-[[(4R)-4-amino-5-hydroxy-1,5-dioxopentyl]amino]-4-methyleneheptanedioic acid IUPAC Name: 2-amino-6-[[(4R)-4-amino-5-hydroxy-5-oxopentanoyl]amino]-4-methylideneheptanedioic acid Traditional Name: 2-amino-6-[[(4R)-4-amino-5-hydroxy-5-keto-pentanoyl]amino]-4-methylene-pimelic acid Formula: C13H21N3O7 MolecularWeight: 331.32174

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H21N3O7/c1-6(4-8(15)12(20)21)5-9(13(22)23)16-10(17)3-2-7(14)11(18)19/h7-9H,1-5,14-15H2,(H,16,17)(H,18,19)(H,20,21)(H,22,23)/t7-,8?,9?/m1/s1