About 2-[4,7-bis(carboxylatomethyl)-10-[2-hydroxy-3-[2-[2-(2-hydroxyethoxy)ethoxy]ethyl-[2-hydroxy-3-[4,7,10-tris(carboxylatomethyl)-1,4,7,10-tetrazacyclododec-1-yl]propyl]amino]propyl]-1,4,7,10-tetrazacyclododec-1-yl]acetate;2-[4,7-bis(carboxymethyl)-10-[2-hydroxy-3-[2-[2-(2-hydroxyethoxy)ethoxy]ethyl-[2-hydroxy-3-[4,7,10-tris(carboxymethyl)-1,4,7,10-tetrazacyclododec-1-yl]propyl]amino]propyl]-1,4,7,10-tetrazacyclododec-1-yl]acetic acid;2-[4,7-bis(carboxymethyl)-10-[2-hydroxy-3-[[2-hydroxy-3-[4,7,10-tris(carboxymethyl)-1,4,7,10-tetrazacyclododec-1-yl]propyl]-[2-[2-(2-phenylmethoxyethoxy)ethoxy]ethyl]amino]propyl]-1,4,7,10-tetrazacyclododec-1-yl]acetic acid;tert-butyl 2-[4-(3-chloro-2-hydroxypropyl)-7,10-bis[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]-1,4,7,10-tetrazacyclododec-1-yl]acetate;tert-butyl 2-[4-[2-hydroxy-3-[[2-hydroxy-3-[4,7,10-tris[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]-1,4,7,10-tetrazacyclododec-1-yl]propyl]-[2-[2-(2-phenylmethoxyethoxy)ethoxy]ethyl]amino]propyl]-7,10-bis[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]-1,4,7,10-tetrazacyclododec-1-yl]acetate;bis(gadolinium(3+));methanol;2-[2-(2-phenylmethoxyethoxy)ethoxy]ethanamine;trichlorogadolinium
2-[4,7-bis(carboxylatomethyl)-10-[2-hydroxy-3-[2-[2-(2-hydroxyethoxy)ethoxy]ethyl-[2-hydroxy-3-[4,7,10-tris(carboxylatomethyl)-1,4,7,10-tetrazacyclododec-1-yl]propyl]amino]propyl]-1,4,7,10-tetrazacyclododec-1-yl]acetate;2-[4,7-bis(carboxymethyl)-10-[2-hydroxy-3-[2-[2-(2-hydroxyethoxy)ethoxy]ethyl-[2-hydroxy-3-[4,7,10-tris(carboxymethyl)-1,4,7,10-tetrazacyclododec-1-yl]propyl]amino]propyl]-1,4,7,10-tetrazacyclododec-1-yl]acetic acid;2-[4,7-bis(carboxymethyl)-10-[2-hydroxy-3-[[2-hydroxy-3-[4,7,10-tris(carboxymethyl)-1,4,7,10-tetrazacyclododec-1-yl]propyl]-[2-[2-(2-phenylmethoxyethoxy)ethoxy]ethyl]amino]propyl]-1,4,7,10-tetrazacyclododec-1-yl]acetic acid;tert-butyl 2-[4-(3-chloro-2-hydroxypropyl)-7,10-bis[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]-1,4,7,10-tetrazacyclododec-1-yl]acetate;tert-butyl 2-[4-[2-hydroxy-3-[[2-hydroxy-3-[4,7,10-tris[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]-1,4,7,10-tetrazacyclododec-1-yl]propyl]-[2-[2-(2-phenylmethoxyethoxy)ethoxy]ethyl]amino]propyl]-7,10-bis[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]-1,4,7,10-tetrazacyclododec-1-yl]acetate;bis(gadolinium(3+));methanol;2-[2-(2-phenylmethoxyethoxy)ethoxy]ethanamine;trichlorogadolinium (PubChem CID 161186392) has the molecular formula C241H434Cl4Gd3N41O79
and a molecular weight of 5783.89 g/mol. Its IUPAC name is 2-[4,7-bis(carboxylatomethyl)-10-[2-hydroxy-3-[2-[2-(2-hydroxyethoxy)ethoxy]ethyl-[2-hydroxy-3-[4,7,10-tris(carboxylatomethyl)-1,4,7,10-tetrazacyclododec-1-yl]propyl]amino]propyl]-1,4,7,10-tetrazacyclododec-1-yl]acetate;2-[4,7-bis(carboxymethyl)-10-[2-hydroxy-3-[2-[2-(2-hydroxyethoxy)ethoxy]ethyl-[2-hydroxy-3-[4,7,10-tris(carboxymethyl)-1,4,7,10-tetrazacyclododec-1-yl]propyl]amino]propyl]-1,4,7,10-tetrazacyclododec-1-yl]acetic acid;2-[4,7-bis(carboxymethyl)-10-[2-hydroxy-3-[[2-hydroxy-3-[4,7,10-tris(carboxymethyl)-1,4,7,10-tetrazacyclododec-1-yl]propyl]-[2-[2-(2-phenylmethoxyethoxy)ethoxy]ethyl]amino]propyl]-1,4,7,10-tetrazacyclododec-1-yl]acetic acid;tert-butyl 2-[4-(3-chloro-2-hydroxypropyl)-7,10-bis[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]-1,4,7,10-tetrazacyclododec-1-yl]acetate;tert-butyl 2-[4-[2-hydroxy-3-[[2-hydroxy-3-[4,7,10-tris[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]-1,4,7,10-tetrazacyclododec-1-yl]propyl]-[2-[2-(2-phenylmethoxyethoxy)ethoxy]ethyl]amino]propyl]-7,10-bis[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]-1,4,7,10-tetrazacyclododec-1-yl]acetate;bis(gadolinium(3+));methanol;2-[2-(2-phenylmethoxyethoxy)ethoxy]ethanamine;trichlorogadolinium.
Frequently Asked Questions
What is the IUPAC name of 2-[4,7-bis(carboxylatomethyl)-10-[2-hydroxy-3-[2-[2-(2-hydroxyethoxy)ethoxy]ethyl-[2-hydroxy-3-[4,7,10-tris(carboxylatomethyl)-1,4,7,10-tetrazacyclododec-1-yl]propyl]amino]propyl]-1,4,7,10-tetrazacyclododec-1-yl]acetate;2-[4,7-bis(carboxymethyl)-10-[2-hydroxy-3-[2-[2-(2-hydroxyethoxy)ethoxy]ethyl-[2-hydroxy-3-[4,7,10-tris(carboxymethyl)-1,4,7,10-tetrazacyclododec-1-yl]propyl]amino]propyl]-1,4,7,10-tetrazacyclododec-1-yl]acetic acid;2-[4,7-bis(carboxymethyl)-10-[2-hydroxy-3-[[2-hydroxy-3-[4,7,10-tris(carboxymethyl)-1,4,7,10-tetrazacyclododec-1-yl]propyl]-[2-[2-(2-phenylmethoxyethoxy)ethoxy]ethyl]amino]propyl]-1,4,7,10-tetrazacyclododec-1-yl]acetic acid;tert-butyl 2-[4-(3-chloro-2-hydroxypropyl)-7,10-bis[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]-1,4,7,10-tetrazacyclododec-1-yl]acetate;tert-butyl 2-[4-[2-hydroxy-3-[[2-hydroxy-3-[4,7,10-tris[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]-1,4,7,10-tetrazacyclododec-1-yl]propyl]-[2-[2-(2-phenylmethoxyethoxy)ethoxy]ethyl]amino]propyl]-7,10-bis[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]-1,4,7,10-tetrazacyclododec-1-yl]acetate;bis(gadolinium(3+));methanol;2-[2-(2-phenylmethoxyethoxy)ethoxy]ethanamine;trichlorogadolinium?
The IUPAC name of 2-[4,7-bis(carboxylatomethyl)-10-[2-hydroxy-3-[2-[2-(2-hydroxyethoxy)ethoxy]ethyl-[2-hydroxy-3-[4,7,10-tris(carboxylatomethyl)-1,4,7,10-tetrazacyclododec-1-yl]propyl]amino]propyl]-1,4,7,10-tetrazacyclododec-1-yl]acetate;2-[4,7-bis(carboxymethyl)-10-[2-hydroxy-3-[2-[2-(2-hydroxyethoxy)ethoxy]ethyl-[2-hydroxy-3-[4,7,10-tris(carboxymethyl)-1,4,7,10-tetrazacyclododec-1-yl]propyl]amino]propyl]-1,4,7,10-tetrazacyclododec-1-yl]acetic acid;2-[4,7-bis(carboxymethyl)-10-[2-hydroxy-3-[[2-hydroxy-3-[4,7,10-tris(carboxymethyl)-1,4,7,10-tetrazacyclododec-1-yl]propyl]-[2-[2-(2-phenylmethoxyethoxy)ethoxy]ethyl]amino]propyl]-1,4,7,10-tetrazacyclododec-1-yl]acetic acid;tert-butyl 2-[4-(3-chloro-2-hydroxypropyl)-7,10-bis[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]-1,4,7,10-tetrazacyclododec-1-yl]acetate;tert-butyl 2-[4-[2-hydroxy-3-[[2-hydroxy-3-[4,7,10-tris[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]-1,4,7,10-tetrazacyclododec-1-yl]propyl]-[2-[2-(2-phenylmethoxyethoxy)ethoxy]ethyl]amino]propyl]-7,10-bis[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]-1,4,7,10-tetrazacyclododec-1-yl]acetate;bis(gadolinium(3+));methanol;2-[2-(2-phenylmethoxyethoxy)ethoxy]ethanamine;trichlorogadolinium (CID 161186392) is 2-[4,7-bis(carboxylatomethyl)-10-[2-hydroxy-3-[2-[2-(2-hydroxyethoxy)ethoxy]ethyl-[2-hydroxy-3-[4,7,10-tris(carboxylatomethyl)-1,4,7,10-tetrazacyclododec-1-yl]propyl]amino]propyl]-1,4,7,10-tetrazacyclododec-1-yl]acetate;2-[4,7-bis(carboxymethyl)-10-[2-hydroxy-3-[2-[2-(2-hydroxyethoxy)ethoxy]ethyl-[2-hydroxy-3-[4,7,10-tris(carboxymethyl)-1,4,7,10-tetrazacyclododec-1-yl]propyl]amino]propyl]-1,4,7,10-tetrazacyclododec-1-yl]acetic acid;2-[4,7-bis(carboxymethyl)-10-[2-hydroxy-3-[[2-hydroxy-3-[4,7,10-tris(carboxymethyl)-1,4,7,10-tetrazacyclododec-1-yl]propyl]-[2-[2-(2-phenylmethoxyethoxy)ethoxy]ethyl]amino]propyl]-1,4,7,10-tetrazacyclododec-1-yl]acetic acid;tert-butyl 2-[4-(3-chloro-2-hydroxypropyl)-7,10-bis[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]-1,4,7,10-tetrazacyclododec-1-yl]acetate;tert-butyl 2-[4-[2-hydroxy-3-[[2-hydroxy-3-[4,7,10-tris[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]-1,4,7,10-tetrazacyclododec-1-yl]propyl]-[2-[2-(2-phenylmethoxyethoxy)ethoxy]ethyl]amino]propyl]-7,10-bis[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]-1,4,7,10-tetrazacyclododec-1-yl]acetate;bis(gadolinium(3+));methanol;2-[2-(2-phenylmethoxyethoxy)ethoxy]ethanamine;trichlorogadolinium.
What is the SMILES notation for 2-[4,7-bis(carboxylatomethyl)-10-[2-hydroxy-3-[2-[2-(2-hydroxyethoxy)ethoxy]ethyl-[2-hydroxy-3-[4,7,10-tris(carboxylatomethyl)-1,4,7,10-tetrazacyclododec-1-yl]propyl]amino]propyl]-1,4,7,10-tetrazacyclododec-1-yl]acetate;2-[4,7-bis(carboxymethyl)-10-[2-hydroxy-3-[2-[2-(2-hydroxyethoxy)ethoxy]ethyl-[2-hydroxy-3-[4,7,10-tris(carboxymethyl)-1,4,7,10-tetrazacyclododec-1-yl]propyl]amino]propyl]-1,4,7,10-tetrazacyclododec-1-yl]acetic acid;2-[4,7-bis(carboxymethyl)-10-[2-hydroxy-3-[[2-hydroxy-3-[4,7,10-tris(carboxymethyl)-1,4,7,10-tetrazacyclododec-1-yl]propyl]-[2-[2-(2-phenylmethoxyethoxy)ethoxy]ethyl]amino]propyl]-1,4,7,10-tetrazacyclododec-1-yl]acetic acid;tert-butyl 2-[4-(3-chloro-2-hydroxypropyl)-7,10-bis[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]-1,4,7,10-tetrazacyclododec-1-yl]acetate;tert-butyl 2-[4-[2-hydroxy-3-[[2-hydroxy-3-[4,7,10-tris[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]-1,4,7,10-tetrazacyclododec-1-yl]propyl]-[2-[2-(2-phenylmethoxyethoxy)ethoxy]ethyl]amino]propyl]-7,10-bis[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]-1,4,7,10-tetrazacyclododec-1-yl]acetate;bis(gadolinium(3+));methanol;2-[2-(2-phenylmethoxyethoxy)ethoxy]ethanamine;trichlorogadolinium?
The canonical SMILES for 2-[4,7-bis(carboxylatomethyl)-10-[2-hydroxy-3-[2-[2-(2-hydroxyethoxy)ethoxy]ethyl-[2-hydroxy-3-[4,7,10-tris(carboxylatomethyl)-1,4,7,10-tetrazacyclododec-1-yl]propyl]amino]propyl]-1,4,7,10-tetrazacyclododec-1-yl]acetate;2-[4,7-bis(carboxymethyl)-10-[2-hydroxy-3-[2-[2-(2-hydroxyethoxy)ethoxy]ethyl-[2-hydroxy-3-[4,7,10-tris(carboxymethyl)-1,4,7,10-tetrazacyclododec-1-yl]propyl]amino]propyl]-1,4,7,10-tetrazacyclododec-1-yl]acetic acid;2-[4,7-bis(carboxymethyl)-10-[2-hydroxy-3-[[2-hydroxy-3-[4,7,10-tris(carboxymethyl)-1,4,7,10-tetrazacyclododec-1-yl]propyl]-[2-[2-(2-phenylmethoxyethoxy)ethoxy]ethyl]amino]propyl]-1,4,7,10-tetrazacyclododec-1-yl]acetic acid;tert-butyl 2-[4-(3-chloro-2-hydroxypropyl)-7,10-bis[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]-1,4,7,10-tetrazacyclododec-1-yl]acetate;tert-butyl 2-[4-[2-hydroxy-3-[[2-hydroxy-3-[4,7,10-tris[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]-1,4,7,10-tetrazacyclododec-1-yl]propyl]-[2-[2-(2-phenylmethoxyethoxy)ethoxy]ethyl]amino]propyl]-7,10-bis[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]-1,4,7,10-tetrazacyclododec-1-yl]acetate;bis(gadolinium(3+));methanol;2-[2-(2-phenylmethoxyethoxy)ethoxy]ethanamine;trichlorogadolinium is CC(C)(C)OC(=O)CN1CCN(CC(=O)OC(C)(C)C)CCN(CC(O)CCl)CCN(CC(=O)OC(C)(C)C)CC1.CC(C)(C)OC(=O)CN1CCN(CC(=O)OC(C)(C)C)CCN(CC(O)CN(CCOCCOCCOCc2ccccc2)CC(O)CN2CCN(CC(=O)OC(C)(C)C)CCN(CC(=O)OC(C)(C)C)CCN(CC(=O)OC(C)(C)C)CC2)CCN(CC(=O)OC(C)(C)C)CC1.CO.Cl[Gd](Cl)Cl.NCCOCCOCCOCc1ccccc1.O=C(O)CN1CCN(CC(=O)O)CCN(CC(O)CN(CCOCCOCCO)CC(O)CN2CCN(CC(=O)O)CCN(CC(=O)O)CCN(CC(=O)O)CC2)CCN(CC(=O)O)CC1.O=C(O)CN1CCN(CC(=O)O)CCN(CC(O)CN(CCOCCOCCOCc2ccccc2)CC(O)CN2CCN(CC(=O)O)CCN(CC(=O)O)CCN(CC(=O)O)CC2)CCN(CC(=O)O)CC1.O=C([O-])CN1CCN(CC(=O)[O-])CCN(CC(O)CN(CCOCCOCCO)CC(O)CN2CCN(CC(=O)[O-])CCN(CC(=O)[O-])CCN(CC(=O)[O-])CC2)CCN(CC(=O)[O-])CC1.[Gd+3].[Gd+3].
What is the InChIKey of 2-[4,7-bis(carboxylatomethyl)-10-[2-hydroxy-3-[2-[2-(2-hydroxyethoxy)ethoxy]ethyl-[2-hydroxy-3-[4,7,10-tris(carboxylatomethyl)-1,4,7,10-tetrazacyclododec-1-yl]propyl]amino]propyl]-1,4,7,10-tetrazacyclododec-1-yl]acetate;2-[4,7-bis(carboxymethyl)-10-[2-hydroxy-3-[2-[2-(2-hydroxyethoxy)ethoxy]ethyl-[2-hydroxy-3-[4,7,10-tris(carboxymethyl)-1,4,7,10-tetrazacyclododec-1-yl]propyl]amino]propyl]-1,4,7,10-tetrazacyclododec-1-yl]acetic acid;2-[4,7-bis(carboxymethyl)-10-[2-hydroxy-3-[[2-hydroxy-3-[4,7,10-tris(carboxymethyl)-1,4,7,10-tetrazacyclododec-1-yl]propyl]-[2-[2-(2-phenylmethoxyethoxy)ethoxy]ethyl]amino]propyl]-1,4,7,10-tetrazacyclododec-1-yl]acetic acid;tert-butyl 2-[4-(3-chloro-2-hydroxypropyl)-7,10-bis[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]-1,4,7,10-tetrazacyclododec-1-yl]acetate;tert-butyl 2-[4-[2-hydroxy-3-[[2-hydroxy-3-[4,7,10-tris[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]-1,4,7,10-tetrazacyclododec-1-yl]propyl]-[2-[2-(2-phenylmethoxyethoxy)ethoxy]ethyl]amino]propyl]-7,10-bis[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]-1,4,7,10-tetrazacyclododec-1-yl]acetate;bis(gadolinium(3+));methanol;2-[2-(2-phenylmethoxyethoxy)ethoxy]ethanamine;trichlorogadolinium?
The InChIKey is UTDFKLXPWBAJDN-UHFFFAOYSA-E. The full InChI is InChI=1S/C71H129N9O17.C47H81N9O17.2C40H75N9O17.C29H55ClN4O7.C13H21NO3.CH4O.3ClH.3Gd/c1-66(2,3)92-60(83)50-74-28-24-72(25-29-75(51-61(84)93-67(4,5)6)33-37-78(36-32-74)54-64(87)96-70(13,14)15)46-58(81)48-80(40-41-89-42-43-90-44-45-91-56-57-22-20-19-21-23-57)49-59(82)47-73-26-30-76(52-62(85)94-68(7,8)9)34-38-79(55-65(88)97-71(16,17)18)39-35-77(31-27-73)53-63(86)95-69(10,11)12;57-40(28-48-6-10-50(32-42(59)60)14-18-54(36-46(67)68)19-15-51(11-7-48)33-43(61)62)30-56(22-23-71-24-25-72-26-27-73-38-39-4-2-1-3-5-39)31-41(58)29-49-8-12-52(34-44(63)64)16-20-55(37-47(69)70)21-17-53(13-9-49)35-45(65)66;2*50-18-20-66-22-21-65-19-17-49(25-33(51)23-41-1-5-43(27-35(53)54)9-13-47(31-39(61)62)14-10-44(6-2-41)28-36(55)56)26-34(52)24-42-3-7-45(29-37(57)58)11-15-48(32-40(63)64)16-12-46(8-4-42)30-38(59)60;1-27(2,3)39-24(36)20-32-12-10-31(19-23(35)18-30)11-13-33(21-25(37)40-28(4,5)6)15-17-34(16-14-32)22-26(38)41-29(7,8)9;14-6-7-15-8-9-16-10-11-17-12-13-4-2-1-3-5-13;1-2;;;;;;/h19-23,58-59,81-82H,24-56H2,1-18H3;1-5,40-41,57-58H,6-38H2,(H,59,60)(H,61,62)(H,63,64)(H,65,66)(H,67,68)(H,69,70);2*33-34,50-52H,1-32H2,(H,53,54)(H,55,56)(H,57,58)(H,59,60)(H,61,62)(H,63,64);23,35H,10-22H2,1-9H3;1-5H,6-12,14H2;2H,1H3;3*1H;;;/q;;;;;;;;;;3*+3/p-9.
What are the key properties of 2-[4,7-bis(carboxylatomethyl)-10-[2-hydroxy-3-[2-[2-(2-hydroxyethoxy)ethoxy]ethyl-[2-hydroxy-3-[4,7,10-tris(carboxylatomethyl)-1,4,7,10-tetrazacyclododec-1-yl]propyl]amino]propyl]-1,4,7,10-tetrazacyclododec-1-yl]acetate;2-[4,7-bis(carboxymethyl)-10-[2-hydroxy-3-[2-[2-(2-hydroxyethoxy)ethoxy]ethyl-[2-hydroxy-3-[4,7,10-tris(carboxymethyl)-1,4,7,10-tetrazacyclododec-1-yl]propyl]amino]propyl]-1,4,7,10-tetrazacyclododec-1-yl]acetic acid;2-[4,7-bis(carboxymethyl)-10-[2-hydroxy-3-[[2-hydroxy-3-[4,7,10-tris(carboxymethyl)-1,4,7,10-tetrazacyclododec-1-yl]propyl]-[2-[2-(2-phenylmethoxyethoxy)ethoxy]ethyl]amino]propyl]-1,4,7,10-tetrazacyclododec-1-yl]acetic acid;tert-butyl 2-[4-(3-chloro-2-hydroxypropyl)-7,10-bis[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]-1,4,7,10-tetrazacyclododec-1-yl]acetate;tert-butyl 2-[4-[2-hydroxy-3-[[2-hydroxy-3-[4,7,10-tris[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]-1,4,7,10-tetrazacyclododec-1-yl]propyl]-[2-[2-(2-phenylmethoxyethoxy)ethoxy]ethyl]amino]propyl]-7,10-bis[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]-1,4,7,10-tetrazacyclododec-1-yl]acetate;bis(gadolinium(3+));methanol;2-[2-(2-phenylmethoxyethoxy)ethoxy]ethanamine;trichlorogadolinium?
2-[4,7-bis(carboxylatomethyl)-10-[2-hydroxy-3-[2-[2-(2-hydroxyethoxy)ethoxy]ethyl-[2-hydroxy-3-[4,7,10-tris(carboxylatomethyl)-1,4,7,10-tetrazacyclododec-1-yl]propyl]amino]propyl]-1,4,7,10-tetrazacyclododec-1-yl]acetate;2-[4,7-bis(carboxymethyl)-10-[2-hydroxy-3-[2-[2-(2-hydroxyethoxy)ethoxy]ethyl-[2-hydroxy-3-[4,7,10-tris(carboxymethyl)-1,4,7,10-tetrazacyclododec-1-yl]propyl]amino]propyl]-1,4,7,10-tetrazacyclododec-1-yl]acetic acid;2-[4,7-bis(carboxymethyl)-10-[2-hydroxy-3-[[2-hydroxy-3-[4,7,10-tris(carboxymethyl)-1,4,7,10-tetrazacyclododec-1-yl]propyl]-[2-[2-(2-phenylmethoxyethoxy)ethoxy]ethyl]amino]propyl]-1,4,7,10-tetrazacyclododec-1-yl]acetic acid;tert-butyl 2-[4-(3-chloro-2-hydroxypropyl)-7,10-bis[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]-1,4,7,10-tetrazacyclododec-1-yl]acetate;tert-butyl 2-[4-[2-hydroxy-3-[[2-hydroxy-3-[4,7,10-tris[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]-1,4,7,10-tetrazacyclododec-1-yl]propyl]-[2-[2-(2-phenylmethoxyethoxy)ethoxy]ethyl]amino]propyl]-7,10-bis[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]-1,4,7,10-tetrazacyclododec-1-yl]acetate;bis(gadolinium(3+));methanol;2-[2-(2-phenylmethoxyethoxy)ethoxy]ethanamine;trichlorogadolinium has a molecular weight of 5783.89 g/mol, XLogP of -15.37, 137 rotatable bonds, 25 hydrogen bond donors, and 108 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4,7-bis(carboxylatomethyl)-10-[2-hydroxy-3-[2-[2-(2-hydroxyethoxy)ethoxy]ethyl-[2-hydroxy-3-[4,7,10-tris(carboxylatomethyl)-1,4,7,10-tetrazacyclododec-1-yl]propyl]amino]propyl]-1,4,7,10-tetrazacyclododec-1-yl]acetate;2-[4,7-bis(carboxymethyl)-10-[2-hydroxy-3-[2-[2-(2-hydroxyethoxy)ethoxy]ethyl-[2-hydroxy-3-[4,7,10-tris(carboxymethyl)-1,4,7,10-tetrazacyclododec-1-yl]propyl]amino]propyl]-1,4,7,10-tetrazacyclododec-1-yl]acetic acid;2-[4,7-bis(carboxymethyl)-10-[2-hydroxy-3-[[2-hydroxy-3-[4,7,10-tris(carboxymethyl)-1,4,7,10-tetrazacyclododec-1-yl]propyl]-[2-[2-(2-phenylmethoxyethoxy)ethoxy]ethyl]amino]propyl]-1,4,7,10-tetrazacyclododec-1-yl]acetic acid;tert-butyl 2-[4-(3-chloro-2-hydroxypropyl)-7,10-bis[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]-1,4,7,10-tetrazacyclododec-1-yl]acetate;tert-butyl 2-[4-[2-hydroxy-3-[[2-hydroxy-3-[4,7,10-tris[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]-1,4,7,10-tetrazacyclododec-1-yl]propyl]-[2-[2-(2-phenylmethoxyethoxy)ethoxy]ethyl]amino]propyl]-7,10-bis[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]-1,4,7,10-tetrazacyclododec-1-yl]acetate;bis(gadolinium(3+));methanol;2-[2-(2-phenylmethoxyethoxy)ethoxy]ethanamine;trichlorogadolinium is sourced from PubChem (CID 161186392), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).