2,10-bis(azanyl)-5-[[[5-azanyl-2,6-bis(oxidanyl)-6-oxidanylidene-hexyl]amino]methyl]-6-[4-(2-azanyl-3-oxidanyl-3-oxidanylidene-propyl)imidazol-1-yl]undecanedioic acid

Systemtic Name: 2,10-bis(azanyl)-5-[[[5-azanyl-2,6-bis(oxidanyl)-6-oxidanylidene-hexyl]amino]methyl]-6-[4-(2-azanyl-3-oxidanyl-3-oxidanylidene-propyl)imidazol-1-yl]undecanedioic acid Openeye Name: 2,10-diamino-5-[[(5-amino-2,6-dihydroxy-6-oxo-hexyl)amino]methyl]-6-[4-(2-amino-3-hydroxy-3-oxo-propyl)imidazol-1-yl]undecanedioic acid CAS Name: 2,10-diamino-5-[[(5-amino-2,6-dihydroxy-6-oxohexyl)amino]methyl]-6-[4-(2-amino-3-hydroxy-3-oxopropyl)-1-imidazolyl]undecanedioic acid IUPAC Name: 2,10-diamino-5-[[(5-amino-2,6-dihydroxy-6-oxohexyl)amino]methyl]-6-[4-(2-amino-3-hydroxy-3-oxopropyl)imidazol-1-yl]undecanedioic acid Traditional Name: 2,10-diamino-5-[[(5-amino-2,6-dihydroxy-6-keto-hexyl)amino]methyl]-6-[4-(2-amino-3-hydroxy-3-keto-propyl)imidazol-1-yl]undecanedioic acid Formula: C24H43N7O9 MolecularWeight: 573.63972

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(N=CN1C(CCCC(C(=O)O)N)C(CCC(C(=O)O)N)CNCC(CCC(C(=O)O)N)O)CC(C(=O)O)N

Isomeric SMILES

C1=C(N=CN1C(CCCC(C(=O)O)N)C(CCC(C(=O)O)N)CNCC(CCC(C(=O)O)N)O)CC(C(=O)O)N

InChI

InChI=1S/C24H43N7O9/c25-16(21(33)34)2-1-3-20(31-11-14(30-12-31)8-19(28)24(39)40)13(4-6-17(26)22(35)36)9-29-10-15(32)5-7-18(27)23(37)38/h11-13,15-20,29,32H,1-10,25-28H2,(H,33,34)(H,35,36)(H,37,38)(H,39,40)