3-[2-[[4-(2-carboxyethyl)-5-[[4-(2-carboxyethyl)-3-(carboxymethyl)-1H-pyrrol-2-yl]-tritio-methyl]-3-(carboxymethyl)-1H-pyrrol-2-yl]-tritio-methyl]-5-[[3-(2-carboxyethyl)-4-(carboxymethyl)-5-[(R)-hydroxy-tritio-methyl]-1H-pyrrol-2-yl]-tritio-methyl]-4-(carboxymethyl)-1H-pyrrol-3-yl]propanoic acid
Molecular Formula:
C40H46N4O17
InChI: InChI=1/C40H46N4O17/c45-17-32-25(12-40(60)61)21(4-8-36(52)53)29(44-32)15-31-24(11-39(58)59)20(3-7-35(50)51)28(43-31)14-30-23(10-38(56)57)19(2-6-34(48)49)27(42-30)13-26-22(9-37(54)55)18(16-41-26)1-5-33(46)47/h16,41-45H,1-15,17H2,(H,46,47)(H,48,49)(H,50,51)(H,52,53)(H,54,55)(H,56,57)(H,58,59)(H,60,61)/i13T,14T,15T,17T/t13u,14u,15u,17-/m1/s1/f/h46,48,50,52,54,56,58,60H
InChIKey: InChIKey=WDFJYRZCZIUBPR-CJGOMHCOHN
SMILES: [H]C([H])(C1=C(C(=C(N1)CC2=C(C(=C(N2)CC3=C(C(=C(N3)CC4=C(C(=CN4)CCC(=O)O)CC(=O)O)CCC(=O)O)CC(=O)O)CCC(=O)O)CC(=O)O)CCC(=O)O)CC(=O)O)O
Names:
3-[2-[[4-(2-carboxyethyl)-5-[[4-(2-carboxyethyl)-3-(carboxymethyl)-1H-pyrrol-2-yl]-tritio-methyl]-3-(carboxymethyl)-1H-pyrrol-2-yl]-tritio-methyl]-5-[[3-(2-carboxyethyl)-4-(carboxymethyl)-5-[(R)-hydroxy-tritio-methyl]-1H-pyrrol-2-yl]-tritio-methyl]-4-(carboxymethyl)-1H-pyrrol-3-yl]propanoic acid
Registries:
PubChem CID 10653197
PubChem ID 15684771
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