About 10-[(1,4-dimethyl-2,5-dioxopyrrolidin-3-yl)methyl]-9-[[5-(2-hydroxyethoxycarbonyl)-10-[[10-methyl-5-[(2-methylpropan-2-yl)oxycarbonyl]-11-oxatetracyclo[6.2.1.13,6.02,7]dodecan-9-yl]methyl]-11-oxatetracyclo[6.2.1.13,6.02,7]dodecan-9-yl]methyl]-11-oxatetracyclo[6.2.1.13,6.02,7]dodecane-4-carboxylic acid;9-[[10-(2-hydroxyethoxycarbonyl)-5-[[10-methyl-5-[(2-methylpropan-2-yl)oxycarbonyl]-11-oxatetracyclo[6.2.1.13,6.02,7]dodecan-9-yl]methyl]-11,12-dithiatetracyclo[6.2.1.13,6.02,7]dodecan-4-yl]methyl]-10-[(4-methyl-2,5-dioxooxolan-3-yl)methyl]-11-oxatetracyclo[6.2.1.13,6.02,7]dodecane-4-carboxylic acid;9-[[5-(3-hydroxypropoxycarbonyl)-10-[[10-methyl-5-[(2-methylpropan-2-yl)oxycarbonyl]-11-oxatetracyclo[6.2.1.13,6.02,7]dodecan-9-yl]methyl]-11-oxatetracyclo[6.2.1.13,6.02,7]dodecan-9-yl]methyl]-5-methoxycarbonyl-10-[(4-methyl-2,5-dioxooxolan-3-yl)methyl]-11-oxatetracyclo[6.2.1.13,6.02,7]dodecane-4-carboxylic acid;9-[[5-(3-hydroxypropoxycarbonyl)-10-[[10-methyl-5-[(2-methylpropan-2-yl)oxycarbonyl]-11-oxatetracyclo[6.2.1.13,6.02,7]dodecan-9-yl]methyl]-11-oxatetracyclo[6.2.1.13,6.02,7]dodecan-9-yl]methyl]-10-[(4-methyl-2,5-dioxooxolan-3-yl)methyl]-11-oxatetracyclo[6.2.1.13,6.02,7]dodecane-4-carboxylic acid
10-[(1,4-dimethyl-2,5-dioxopyrrolidin-3-yl)methyl]-9-[[5-(2-hydroxyethoxycarbonyl)-10-[[10-methyl-5-[(2-methylpropan-2-yl)oxycarbonyl]-11-oxatetracyclo[6.2.1.13,6.02,7]dodecan-9-yl]methyl]-11-oxatetracyclo[6.2.1.13,6.02,7]dodecan-9-yl]methyl]-11-oxatetracyclo[6.2.1.13,6.02,7]dodecane-4-carboxylic acid;9-[[10-(2-hydroxyethoxycarbonyl)-5-[[10-methyl-5-[(2-methylpropan-2-yl)oxycarbonyl]-11-oxatetracyclo[6.2.1.13,6.02,7]dodecan-9-yl]methyl]-11,12-dithiatetracyclo[6.2.1.13,6.02,7]dodecan-4-yl]methyl]-10-[(4-methyl-2,5-dioxooxolan-3-yl)methyl]-11-oxatetracyclo[6.2.1.13,6.02,7]dodecane-4-carboxylic acid;9-[[5-(3-hydroxypropoxycarbonyl)-10-[[10-methyl-5-[(2-methylpropan-2-yl)oxycarbonyl]-11-oxatetracyclo[6.2.1.13,6.02,7]dodecan-9-yl]methyl]-11-oxatetracyclo[6.2.1.13,6.02,7]dodecan-9-yl]methyl]-5-methoxycarbonyl-10-[(4-methyl-2,5-dioxooxolan-3-yl)methyl]-11-oxatetracyclo[6.2.1.13,6.02,7]dodecane-4-carboxylic acid;9-[[5-(3-hydroxypropoxycarbonyl)-10-[[10-methyl-5-[(2-methylpropan-2-yl)oxycarbonyl]-11-oxatetracyclo[6.2.1.13,6.02,7]dodecan-9-yl]methyl]-11-oxatetracyclo[6.2.1.13,6.02,7]dodecan-9-yl]methyl]-10-[(4-methyl-2,5-dioxooxolan-3-yl)methyl]-11-oxatetracyclo[6.2.1.13,6.02,7]dodecane-4-carboxylic acid (PubChem CID 157418780) has the molecular formula C208H279NO52S2
and a molecular weight of 3689.61 g/mol. Its IUPAC name is 10-[(1,4-dimethyl-2,5-dioxopyrrolidin-3-yl)methyl]-9-[[5-(2-hydroxyethoxycarbonyl)-10-[[10-methyl-5-[(2-methylpropan-2-yl)oxycarbonyl]-11-oxatetracyclo[6.2.1.13,6.02,7]dodecan-9-yl]methyl]-11-oxatetracyclo[6.2.1.13,6.02,7]dodecan-9-yl]methyl]-11-oxatetracyclo[6.2.1.13,6.02,7]dodecane-4-carboxylic acid;9-[[10-(2-hydroxyethoxycarbonyl)-5-[[10-methyl-5-[(2-methylpropan-2-yl)oxycarbonyl]-11-oxatetracyclo[6.2.1.13,6.02,7]dodecan-9-yl]methyl]-11,12-dithiatetracyclo[6.2.1.13,6.02,7]dodecan-4-yl]methyl]-10-[(4-methyl-2,5-dioxooxolan-3-yl)methyl]-11-oxatetracyclo[6.2.1.13,6.02,7]dodecane-4-carboxylic acid;9-[[5-(3-hydroxypropoxycarbonyl)-10-[[10-methyl-5-[(2-methylpropan-2-yl)oxycarbonyl]-11-oxatetracyclo[6.2.1.13,6.02,7]dodecan-9-yl]methyl]-11-oxatetracyclo[6.2.1.13,6.02,7]dodecan-9-yl]methyl]-5-methoxycarbonyl-10-[(4-methyl-2,5-dioxooxolan-3-yl)methyl]-11-oxatetracyclo[6.2.1.13,6.02,7]dodecane-4-carboxylic acid;9-[[5-(3-hydroxypropoxycarbonyl)-10-[[10-methyl-5-[(2-methylpropan-2-yl)oxycarbonyl]-11-oxatetracyclo[6.2.1.13,6.02,7]dodecan-9-yl]methyl]-11-oxatetracyclo[6.2.1.13,6.02,7]dodecan-9-yl]methyl]-10-[(4-methyl-2,5-dioxooxolan-3-yl)methyl]-11-oxatetracyclo[6.2.1.13,6.02,7]dodecane-4-carboxylic acid.
Frequently Asked Questions
What is the IUPAC name of 10-[(1,4-dimethyl-2,5-dioxopyrrolidin-3-yl)methyl]-9-[[5-(2-hydroxyethoxycarbonyl)-10-[[10-methyl-5-[(2-methylpropan-2-yl)oxycarbonyl]-11-oxatetracyclo[6.2.1.13,6.02,7]dodecan-9-yl]methyl]-11-oxatetracyclo[6.2.1.13,6.02,7]dodecan-9-yl]methyl]-11-oxatetracyclo[6.2.1.13,6.02,7]dodecane-4-carboxylic acid;9-[[10-(2-hydroxyethoxycarbonyl)-5-[[10-methyl-5-[(2-methylpropan-2-yl)oxycarbonyl]-11-oxatetracyclo[6.2.1.13,6.02,7]dodecan-9-yl]methyl]-11,12-dithiatetracyclo[6.2.1.13,6.02,7]dodecan-4-yl]methyl]-10-[(4-methyl-2,5-dioxooxolan-3-yl)methyl]-11-oxatetracyclo[6.2.1.13,6.02,7]dodecane-4-carboxylic acid;9-[[5-(3-hydroxypropoxycarbonyl)-10-[[10-methyl-5-[(2-methylpropan-2-yl)oxycarbonyl]-11-oxatetracyclo[6.2.1.13,6.02,7]dodecan-9-yl]methyl]-11-oxatetracyclo[6.2.1.13,6.02,7]dodecan-9-yl]methyl]-5-methoxycarbonyl-10-[(4-methyl-2,5-dioxooxolan-3-yl)methyl]-11-oxatetracyclo[6.2.1.13,6.02,7]dodecane-4-carboxylic acid;9-[[5-(3-hydroxypropoxycarbonyl)-10-[[10-methyl-5-[(2-methylpropan-2-yl)oxycarbonyl]-11-oxatetracyclo[6.2.1.13,6.02,7]dodecan-9-yl]methyl]-11-oxatetracyclo[6.2.1.13,6.02,7]dodecan-9-yl]methyl]-10-[(4-methyl-2,5-dioxooxolan-3-yl)methyl]-11-oxatetracyclo[6.2.1.13,6.02,7]dodecane-4-carboxylic acid?
The IUPAC name of 10-[(1,4-dimethyl-2,5-dioxopyrrolidin-3-yl)methyl]-9-[[5-(2-hydroxyethoxycarbonyl)-10-[[10-methyl-5-[(2-methylpropan-2-yl)oxycarbonyl]-11-oxatetracyclo[6.2.1.13,6.02,7]dodecan-9-yl]methyl]-11-oxatetracyclo[6.2.1.13,6.02,7]dodecan-9-yl]methyl]-11-oxatetracyclo[6.2.1.13,6.02,7]dodecane-4-carboxylic acid;9-[[10-(2-hydroxyethoxycarbonyl)-5-[[10-methyl-5-[(2-methylpropan-2-yl)oxycarbonyl]-11-oxatetracyclo[6.2.1.13,6.02,7]dodecan-9-yl]methyl]-11,12-dithiatetracyclo[6.2.1.13,6.02,7]dodecan-4-yl]methyl]-10-[(4-methyl-2,5-dioxooxolan-3-yl)methyl]-11-oxatetracyclo[6.2.1.13,6.02,7]dodecane-4-carboxylic acid;9-[[5-(3-hydroxypropoxycarbonyl)-10-[[10-methyl-5-[(2-methylpropan-2-yl)oxycarbonyl]-11-oxatetracyclo[6.2.1.13,6.02,7]dodecan-9-yl]methyl]-11-oxatetracyclo[6.2.1.13,6.02,7]dodecan-9-yl]methyl]-5-methoxycarbonyl-10-[(4-methyl-2,5-dioxooxolan-3-yl)methyl]-11-oxatetracyclo[6.2.1.13,6.02,7]dodecane-4-carboxylic acid;9-[[5-(3-hydroxypropoxycarbonyl)-10-[[10-methyl-5-[(2-methylpropan-2-yl)oxycarbonyl]-11-oxatetracyclo[6.2.1.13,6.02,7]dodecan-9-yl]methyl]-11-oxatetracyclo[6.2.1.13,6.02,7]dodecan-9-yl]methyl]-10-[(4-methyl-2,5-dioxooxolan-3-yl)methyl]-11-oxatetracyclo[6.2.1.13,6.02,7]dodecane-4-carboxylic acid (CID 157418780) is 10-[(1,4-dimethyl-2,5-dioxopyrrolidin-3-yl)methyl]-9-[[5-(2-hydroxyethoxycarbonyl)-10-[[10-methyl-5-[(2-methylpropan-2-yl)oxycarbonyl]-11-oxatetracyclo[6.2.1.13,6.02,7]dodecan-9-yl]methyl]-11-oxatetracyclo[6.2.1.13,6.02,7]dodecan-9-yl]methyl]-11-oxatetracyclo[6.2.1.13,6.02,7]dodecane-4-carboxylic acid;9-[[10-(2-hydroxyethoxycarbonyl)-5-[[10-methyl-5-[(2-methylpropan-2-yl)oxycarbonyl]-11-oxatetracyclo[6.2.1.13,6.02,7]dodecan-9-yl]methyl]-11,12-dithiatetracyclo[6.2.1.13,6.02,7]dodecan-4-yl]methyl]-10-[(4-methyl-2,5-dioxooxolan-3-yl)methyl]-11-oxatetracyclo[6.2.1.13,6.02,7]dodecane-4-carboxylic acid;9-[[5-(3-hydroxypropoxycarbonyl)-10-[[10-methyl-5-[(2-methylpropan-2-yl)oxycarbonyl]-11-oxatetracyclo[6.2.1.13,6.02,7]dodecan-9-yl]methyl]-11-oxatetracyclo[6.2.1.13,6.02,7]dodecan-9-yl]methyl]-5-methoxycarbonyl-10-[(4-methyl-2,5-dioxooxolan-3-yl)methyl]-11-oxatetracyclo[6.2.1.13,6.02,7]dodecane-4-carboxylic acid;9-[[5-(3-hydroxypropoxycarbonyl)-10-[[10-methyl-5-[(2-methylpropan-2-yl)oxycarbonyl]-11-oxatetracyclo[6.2.1.13,6.02,7]dodecan-9-yl]methyl]-11-oxatetracyclo[6.2.1.13,6.02,7]dodecan-9-yl]methyl]-10-[(4-methyl-2,5-dioxooxolan-3-yl)methyl]-11-oxatetracyclo[6.2.1.13,6.02,7]dodecane-4-carboxylic acid.
What is the SMILES notation for 10-[(1,4-dimethyl-2,5-dioxopyrrolidin-3-yl)methyl]-9-[[5-(2-hydroxyethoxycarbonyl)-10-[[10-methyl-5-[(2-methylpropan-2-yl)oxycarbonyl]-11-oxatetracyclo[6.2.1.13,6.02,7]dodecan-9-yl]methyl]-11-oxatetracyclo[6.2.1.13,6.02,7]dodecan-9-yl]methyl]-11-oxatetracyclo[6.2.1.13,6.02,7]dodecane-4-carboxylic acid;9-[[10-(2-hydroxyethoxycarbonyl)-5-[[10-methyl-5-[(2-methylpropan-2-yl)oxycarbonyl]-11-oxatetracyclo[6.2.1.13,6.02,7]dodecan-9-yl]methyl]-11,12-dithiatetracyclo[6.2.1.13,6.02,7]dodecan-4-yl]methyl]-10-[(4-methyl-2,5-dioxooxolan-3-yl)methyl]-11-oxatetracyclo[6.2.1.13,6.02,7]dodecane-4-carboxylic acid;9-[[5-(3-hydroxypropoxycarbonyl)-10-[[10-methyl-5-[(2-methylpropan-2-yl)oxycarbonyl]-11-oxatetracyclo[6.2.1.13,6.02,7]dodecan-9-yl]methyl]-11-oxatetracyclo[6.2.1.13,6.02,7]dodecan-9-yl]methyl]-5-methoxycarbonyl-10-[(4-methyl-2,5-dioxooxolan-3-yl)methyl]-11-oxatetracyclo[6.2.1.13,6.02,7]dodecane-4-carboxylic acid;9-[[5-(3-hydroxypropoxycarbonyl)-10-[[10-methyl-5-[(2-methylpropan-2-yl)oxycarbonyl]-11-oxatetracyclo[6.2.1.13,6.02,7]dodecan-9-yl]methyl]-11-oxatetracyclo[6.2.1.13,6.02,7]dodecan-9-yl]methyl]-10-[(4-methyl-2,5-dioxooxolan-3-yl)methyl]-11-oxatetracyclo[6.2.1.13,6.02,7]dodecane-4-carboxylic acid?
The canonical SMILES for 10-[(1,4-dimethyl-2,5-dioxopyrrolidin-3-yl)methyl]-9-[[5-(2-hydroxyethoxycarbonyl)-10-[[10-methyl-5-[(2-methylpropan-2-yl)oxycarbonyl]-11-oxatetracyclo[6.2.1.13,6.02,7]dodecan-9-yl]methyl]-11-oxatetracyclo[6.2.1.13,6.02,7]dodecan-9-yl]methyl]-11-oxatetracyclo[6.2.1.13,6.02,7]dodecane-4-carboxylic acid;9-[[10-(2-hydroxyethoxycarbonyl)-5-[[10-methyl-5-[(2-methylpropan-2-yl)oxycarbonyl]-11-oxatetracyclo[6.2.1.13,6.02,7]dodecan-9-yl]methyl]-11,12-dithiatetracyclo[6.2.1.13,6.02,7]dodecan-4-yl]methyl]-10-[(4-methyl-2,5-dioxooxolan-3-yl)methyl]-11-oxatetracyclo[6.2.1.13,6.02,7]dodecane-4-carboxylic acid;9-[[5-(3-hydroxypropoxycarbonyl)-10-[[10-methyl-5-[(2-methylpropan-2-yl)oxycarbonyl]-11-oxatetracyclo[6.2.1.13,6.02,7]dodecan-9-yl]methyl]-11-oxatetracyclo[6.2.1.13,6.02,7]dodecan-9-yl]methyl]-5-methoxycarbonyl-10-[(4-methyl-2,5-dioxooxolan-3-yl)methyl]-11-oxatetracyclo[6.2.1.13,6.02,7]dodecane-4-carboxylic acid;9-[[5-(3-hydroxypropoxycarbonyl)-10-[[10-methyl-5-[(2-methylpropan-2-yl)oxycarbonyl]-11-oxatetracyclo[6.2.1.13,6.02,7]dodecan-9-yl]methyl]-11-oxatetracyclo[6.2.1.13,6.02,7]dodecan-9-yl]methyl]-10-[(4-methyl-2,5-dioxooxolan-3-yl)methyl]-11-oxatetracyclo[6.2.1.13,6.02,7]dodecane-4-carboxylic acid is CC1C(=O)N(C)C(=O)C1CC1C(CC2C(CC3C(C)C4OC3C3C5CC(CC5C(=O)OC(C)(C)C)C43)C3OC2C2C4CC(CC4C(=O)OCCO)C32)C2OC1C1C3CC(CC3C(=O)O)C21.CC1C(=O)OC(=O)C1CC1C(CC2C(CC3C(C)C4OC3C3C5CC(CC5C(=O)OC(C)(C)C)C43)C3OC2C2C4CC(CC4C(=O)OCCCO)C32)C2OC1C1C3CC(CC3C(=O)O)C21.CC1C(=O)OC(=O)C1CC1C(CC2C(CC3C(C)C4OC3C3C5CC(CC5C(=O)OC(C)(C)C)C43)C3SC2C2C4SC(CC4C(=O)OCCO)C32)C2OC1C1C3CC(CC3C(=O)O)C21.COC(=O)C1C2CC(C1C(=O)O)C1C3OC(C(CC4C(CC5C(C)C6OC5C5C7CC(CC7C(=O)OC(C)(C)C)C65)C5OC4C4C6CC(CC6C(=O)OCCCO)C54)C3CC3C(=O)OC(=O)C3C)C21.
What is the InChIKey of 10-[(1,4-dimethyl-2,5-dioxopyrrolidin-3-yl)methyl]-9-[[5-(2-hydroxyethoxycarbonyl)-10-[[10-methyl-5-[(2-methylpropan-2-yl)oxycarbonyl]-11-oxatetracyclo[6.2.1.13,6.02,7]dodecan-9-yl]methyl]-11-oxatetracyclo[6.2.1.13,6.02,7]dodecan-9-yl]methyl]-11-oxatetracyclo[6.2.1.13,6.02,7]dodecane-4-carboxylic acid;9-[[10-(2-hydroxyethoxycarbonyl)-5-[[10-methyl-5-[(2-methylpropan-2-yl)oxycarbonyl]-11-oxatetracyclo[6.2.1.13,6.02,7]dodecan-9-yl]methyl]-11,12-dithiatetracyclo[6.2.1.13,6.02,7]dodecan-4-yl]methyl]-10-[(4-methyl-2,5-dioxooxolan-3-yl)methyl]-11-oxatetracyclo[6.2.1.13,6.02,7]dodecane-4-carboxylic acid;9-[[5-(3-hydroxypropoxycarbonyl)-10-[[10-methyl-5-[(2-methylpropan-2-yl)oxycarbonyl]-11-oxatetracyclo[6.2.1.13,6.02,7]dodecan-9-yl]methyl]-11-oxatetracyclo[6.2.1.13,6.02,7]dodecan-9-yl]methyl]-5-methoxycarbonyl-10-[(4-methyl-2,5-dioxooxolan-3-yl)methyl]-11-oxatetracyclo[6.2.1.13,6.02,7]dodecane-4-carboxylic acid;9-[[5-(3-hydroxypropoxycarbonyl)-10-[[10-methyl-5-[(2-methylpropan-2-yl)oxycarbonyl]-11-oxatetracyclo[6.2.1.13,6.02,7]dodecan-9-yl]methyl]-11-oxatetracyclo[6.2.1.13,6.02,7]dodecan-9-yl]methyl]-10-[(4-methyl-2,5-dioxooxolan-3-yl)methyl]-11-oxatetracyclo[6.2.1.13,6.02,7]dodecane-4-carboxylic acid?
The InChIKey is BPDWKOHFGVOOKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C54H72O15.C52H71NO12.C52H70O13.C50H66O12S2/c1-18-22(43-36-25-10-20(34(36)42(18)65-43)13-31(25)52(61)69-54(3,4)5)14-26-28(45-37-24-11-21(35(37)44(26)66-45)12-30(24)50(59)64-9-7-8-55)16-29-27(15-23-19(2)49(58)68-51(23)60)46-38-32-17-33(39(38)47(29)67-46)41(53(62)63-6)40(32)48(56)57;1-18-23(42-39-27-10-21(35(39)41(18)62-42)14-34(27)51(60)65-52(3,4)5)15-28-31(46-40-26-11-22(37(40)43(28)63-46)13-33(26)50(59)61-8-7-54)17-30-29(16-24-19(2)47(55)53(6)48(24)56)45-38-25-9-20(12-32(25)49(57)58)36(38)44(30)64-45;1-18-23(42-39-27-10-21(35(39)41(18)61-42)14-34(27)51(59)65-52(3,4)5)15-28-31(46-40-26-11-22(37(40)43(28)62-46)13-33(26)49(57)60-8-6-7-53)17-30-29(16-24-19(2)48(56)64-50(24)58)45-38-25-9-20(12-32(25)47(54)55)36(38)44(30)63-45;1-16-20(39-35-23-9-19(32(35)38(16)59-39)11-29(23)49(57)62-50(3,4)5)12-26-27(43-37-36(42(26)64-43)31-15-30(44(37)63-31)47(55)58-7-6-51)14-25-24(13-21-17(2)46(54)61-48(21)56)41-34-22-8-18(10-28(22)45(52)53)33(34)40(25)60-41/h18-47,55H,7-17H2,1-6H3,(H,56,57);18-46,54H,7-17H2,1-6H3,(H,57,58);18-46,53H,6-17H2,1-5H3,(H,54,55);16-44,51H,6-15H2,1-5H3,(H,52,53).
What are the key properties of 10-[(1,4-dimethyl-2,5-dioxopyrrolidin-3-yl)methyl]-9-[[5-(2-hydroxyethoxycarbonyl)-10-[[10-methyl-5-[(2-methylpropan-2-yl)oxycarbonyl]-11-oxatetracyclo[6.2.1.13,6.02,7]dodecan-9-yl]methyl]-11-oxatetracyclo[6.2.1.13,6.02,7]dodecan-9-yl]methyl]-11-oxatetracyclo[6.2.1.13,6.02,7]dodecane-4-carboxylic acid;9-[[10-(2-hydroxyethoxycarbonyl)-5-[[10-methyl-5-[(2-methylpropan-2-yl)oxycarbonyl]-11-oxatetracyclo[6.2.1.13,6.02,7]dodecan-9-yl]methyl]-11,12-dithiatetracyclo[6.2.1.13,6.02,7]dodecan-4-yl]methyl]-10-[(4-methyl-2,5-dioxooxolan-3-yl)methyl]-11-oxatetracyclo[6.2.1.13,6.02,7]dodecane-4-carboxylic acid;9-[[5-(3-hydroxypropoxycarbonyl)-10-[[10-methyl-5-[(2-methylpropan-2-yl)oxycarbonyl]-11-oxatetracyclo[6.2.1.13,6.02,7]dodecan-9-yl]methyl]-11-oxatetracyclo[6.2.1.13,6.02,7]dodecan-9-yl]methyl]-5-methoxycarbonyl-10-[(4-methyl-2,5-dioxooxolan-3-yl)methyl]-11-oxatetracyclo[6.2.1.13,6.02,7]dodecane-4-carboxylic acid;9-[[5-(3-hydroxypropoxycarbonyl)-10-[[10-methyl-5-[(2-methylpropan-2-yl)oxycarbonyl]-11-oxatetracyclo[6.2.1.13,6.02,7]dodecan-9-yl]methyl]-11-oxatetracyclo[6.2.1.13,6.02,7]dodecan-9-yl]methyl]-10-[(4-methyl-2,5-dioxooxolan-3-yl)methyl]-11-oxatetracyclo[6.2.1.13,6.02,7]dodecane-4-carboxylic acid?
10-[(1,4-dimethyl-2,5-dioxopyrrolidin-3-yl)methyl]-9-[[5-(2-hydroxyethoxycarbonyl)-10-[[10-methyl-5-[(2-methylpropan-2-yl)oxycarbonyl]-11-oxatetracyclo[6.2.1.13,6.02,7]dodecan-9-yl]methyl]-11-oxatetracyclo[6.2.1.13,6.02,7]dodecan-9-yl]methyl]-11-oxatetracyclo[6.2.1.13,6.02,7]dodecane-4-carboxylic acid;9-[[10-(2-hydroxyethoxycarbonyl)-5-[[10-methyl-5-[(2-methylpropan-2-yl)oxycarbonyl]-11-oxatetracyclo[6.2.1.13,6.02,7]dodecan-9-yl]methyl]-11,12-dithiatetracyclo[6.2.1.13,6.02,7]dodecan-4-yl]methyl]-10-[(4-methyl-2,5-dioxooxolan-3-yl)methyl]-11-oxatetracyclo[6.2.1.13,6.02,7]dodecane-4-carboxylic acid;9-[[5-(3-hydroxypropoxycarbonyl)-10-[[10-methyl-5-[(2-methylpropan-2-yl)oxycarbonyl]-11-oxatetracyclo[6.2.1.13,6.02,7]dodecan-9-yl]methyl]-11-oxatetracyclo[6.2.1.13,6.02,7]dodecan-9-yl]methyl]-5-methoxycarbonyl-10-[(4-methyl-2,5-dioxooxolan-3-yl)methyl]-11-oxatetracyclo[6.2.1.13,6.02,7]dodecane-4-carboxylic acid;9-[[5-(3-hydroxypropoxycarbonyl)-10-[[10-methyl-5-[(2-methylpropan-2-yl)oxycarbonyl]-11-oxatetracyclo[6.2.1.13,6.02,7]dodecan-9-yl]methyl]-11-oxatetracyclo[6.2.1.13,6.02,7]dodecan-9-yl]methyl]-10-[(4-methyl-2,5-dioxooxolan-3-yl)methyl]-11-oxatetracyclo[6.2.1.13,6.02,7]dodecane-4-carboxylic acid has a molecular weight of 3689.61 g/mol, XLogP of 21.38, 47 rotatable bonds, 8 hydrogen bond donors, and 50 hydrogen bond acceptors.
Where does this data come from?
All data for 10-[(1,4-dimethyl-2,5-dioxopyrrolidin-3-yl)methyl]-9-[[5-(2-hydroxyethoxycarbonyl)-10-[[10-methyl-5-[(2-methylpropan-2-yl)oxycarbonyl]-11-oxatetracyclo[6.2.1.13,6.02,7]dodecan-9-yl]methyl]-11-oxatetracyclo[6.2.1.13,6.02,7]dodecan-9-yl]methyl]-11-oxatetracyclo[6.2.1.13,6.02,7]dodecane-4-carboxylic acid;9-[[10-(2-hydroxyethoxycarbonyl)-5-[[10-methyl-5-[(2-methylpropan-2-yl)oxycarbonyl]-11-oxatetracyclo[6.2.1.13,6.02,7]dodecan-9-yl]methyl]-11,12-dithiatetracyclo[6.2.1.13,6.02,7]dodecan-4-yl]methyl]-10-[(4-methyl-2,5-dioxooxolan-3-yl)methyl]-11-oxatetracyclo[6.2.1.13,6.02,7]dodecane-4-carboxylic acid;9-[[5-(3-hydroxypropoxycarbonyl)-10-[[10-methyl-5-[(2-methylpropan-2-yl)oxycarbonyl]-11-oxatetracyclo[6.2.1.13,6.02,7]dodecan-9-yl]methyl]-11-oxatetracyclo[6.2.1.13,6.02,7]dodecan-9-yl]methyl]-5-methoxycarbonyl-10-[(4-methyl-2,5-dioxooxolan-3-yl)methyl]-11-oxatetracyclo[6.2.1.13,6.02,7]dodecane-4-carboxylic acid;9-[[5-(3-hydroxypropoxycarbonyl)-10-[[10-methyl-5-[(2-methylpropan-2-yl)oxycarbonyl]-11-oxatetracyclo[6.2.1.13,6.02,7]dodecan-9-yl]methyl]-11-oxatetracyclo[6.2.1.13,6.02,7]dodecan-9-yl]methyl]-10-[(4-methyl-2,5-dioxooxolan-3-yl)methyl]-11-oxatetracyclo[6.2.1.13,6.02,7]dodecane-4-carboxylic acid is sourced from PubChem (CID 157418780), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).