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3-[[4,6-bis(2-carboxyethylamino)-1,3,5-triazin-2-yl]amino]propanoic acid; 2-[[4,6-bis(carboxymethylamino)-1,3,5-triazin-2-yl]amino]ethanoic acid; 4-[[4,6-bis[(3-methyl-4-oxidanyl-4-oxidanylidene-butyl)amino]-1,3,5-triazin-2-yl]amino]-2-methyl-butanoic acid; 4-[[4,6-bis[(4-oxidanyl-4-oxidanylidene-butyl)amino]-1,3,5-triazin-2-yl]amino]butanoic acid; 6-[[4,6-bis[(6-oxidanyl-6-oxidanylidene-hexyl)amino]-1,3,5-triazin-2-yl]amino]hexanoic acid

Systemtic Name:	3-[[4,6-bis(2-carboxyethylamino)-1,3,5-triazin-2-yl]amino]propanoic acid; 2-[[4,6-bis(carboxymethylamino)-1,3,5-triazin-2-yl]amino]ethanoic acid; 4-[[4,6-bis[(3-methyl-4-oxidanyl-4-oxidanylidene-butyl)amino]-1,3,5-triazin-2-yl]amino]-2-methyl-butanoic acid; 4-[[4,6-bis[(4-oxidanyl-4-oxidanylidene-butyl)amino]-1,3,5-triazin-2-yl]amino]butanoic acid; 6-[[4,6-bis[(6-oxidanyl-6-oxidanylidene-hexyl)amino]-1,3,5-triazin-2-yl]amino]hexanoic acid
Openeye Name:	3-[[4,6-bis(2-carboxyethylamino)-1,3,5-triazin-2-yl]amino]propanoic acid; 2-[[4,6-bis(carboxymethylamino)-1,3,5-triazin-2-yl]amino]acetic acid; 4-[[4,6-bis[(4-hydroxy-3-methyl-4-oxo-butyl)amino]-1,3,5-triazin-2-yl]amino]-2-methyl-butanoic acid; 4-[[4,6-bis[(4-hydroxy-4-oxo-butyl)amino]-1,3,5-triazin-2-yl]amino]butanoic acid; 6-[[4,6-bis[(6-hydroxy-6-oxo-hexyl)amino]-1,3,5-triazin-2-yl]amino]hexanoic acid
CAS Name:	3-[[4,6-bis(2-carboxyethylamino)-1,3,5-triazin-2-yl]amino]propanoic acid; 2-[[4,6-bis(carboxymethylamino)-1,3,5-triazin-2-yl]amino]acetic acid; 4-[[4,6-bis[(4-hydroxy-3-methyl-4-oxobutyl)amino]-1,3,5-triazin-2-yl]amino]-2-methylbutanoic acid; 4-[[4,6-bis[(4-hydroxy-4-oxobutyl)amino]-1,3,5-triazin-2-yl]amino]butanoic acid; 6-[[4,6-bis[(6-hydroxy-6-oxohexyl)amino]-1,3,5-triazin-2-yl]amino]hexanoic acid
IUPAC Name:	3-[[4,6-bis(2-carboxyethylamino)-1,3,5-triazin-2-yl]amino]propanoic acid; 2-[[4,6-bis(carboxymethylamino)-1,3,5-triazin-2-yl]amino]acetic acid; 4-[[4,6-bis[(4-hydroxy-3-methyl-4-oxobutyl)amino]-1,3,5-triazin-2-yl]amino]-2-methylbutanoic acid; 4-[[4,6-bis[(4-hydroxy-4-oxobutyl)amino]-1,3,5-triazin-2-yl]amino]butanoic acid; 6-[[4,6-bis[(6-hydroxy-6-oxohexyl)amino]-1,3,5-triazin-2-yl]amino]hexanoic acid
Traditional Name:	3-[[4,6-bis(2-carboxyethylamino)-s-triazin-2-yl]amino]propionic acid; 2-[[4,6-bis(carboxymethylamino)-s-triazin-2-yl]amino]acetic acid; 4-[[4,6-bis[(4-hydroxy-4-keto-butyl)amino]-s-triazin-2-yl]amino]butyric acid; 6-[[4,6-bis[(6-hydroxy-6-keto-hexyl)amino]-s-triazin-2-yl]amino]hexanoic acid; 4-[[4,6-bis[(4-hydroxy-4-keto-3-methyl-butyl)amino]-s-triazin-2-yl]amino]-2-methyl-butyric acid
Formula:	C₇₅H₁₂₀N₃₀O₃₀
MolecularWeight:	1921.9383

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCNC1=NC(=NC(=N1)NCCC(C)C(=O)O)NCCC(C)C(=O)O)C(=O)O.C(CCC(=O)O)CCNC1=NC(=NC(=N1)NCCCCCC(=O)O)NCCCCCC(=O)O.C(CC(=O)O)CNC1=NC(=NC(=N1)NCCCC(=O)O)NCCCC(=O)O.C(CNC1=NC(=NC(=N1)NCCC(=O)O)NCCC(=O)O)C(=O)O.C(C(=O)O)NC1=NC(=NC(=N1)NCC(=O)O)NCC(=O)O

Isomeric SMILES

InChI

InChI=1S/C21H36N6O6.C18H30N6O6.C15H24N6O6.C12H18N6O6.C9H12N6O6/c28-16(29)10-4-1-7-13-22-19-25-20(23-14-8-2-5-11-17(30)31)27-21(26-19)24-15-9-3-6-12-18(32)33;1-10(13(25)26)4-7-19-16-22-17(20-8-5-11(2)14(27)28)24-18(23-16)21-9-6-12(3)15(29)30;22-10(23)4-1-7-16-13-19-14(17-8-2-5-11(24)25)21-15(20-13)18-9-3-6-12(26)27;19-7(20)1-4-13-10-16-11(14-5-2-8(21)22)18-12(17-10)15-6-3-9(23)24;16-4(17)1-10-7-13-8(11-2-5(18)19)15-9(14-7)12-3-6(20)21/h1-15H2,(H,28,29)(H,30,31)(H,32,33)(H3,22,23,24,25,26,27);10-12H,4-9H2,1-3H3,(H,25,26)(H,27,28)(H,29,30)(H3,19,20,21,22,23,24);1-9H2,(H,22,23)(H,24,25)(H,26,27)(H3,16,17,18,19,20,21);1-6H2,(H,19,20)(H,21,22)(H,23,24)(H3,13,14,15,16,17,18);1-3H2,(H,16,17)(H,18,19)(H,20,21)(H3,10,11,12,13,14,15)

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