About [(2R,5R)-4-amino-5-(2,4-dioxopyrimidin-1-yl)-3-[methoxy(phenyl)phosphoryl]oxyoxolan-2-yl]methyl 2,2-dimethylpropanoate;[(2R,5R)-3-[2-[bis(4-methoxyphenyl)-phenylmethoxy]ethoxy-methoxyphosphoryl]oxy-5-(2,4-dioxopyrimidin-1-yl)-4-(methylamino)oxolan-2-yl]methyl 2,2-dimethylpropanoate;[(2R,5R)-3-[[4-[[bis(4-methoxyphenyl)-phenylmethoxy]methyl]phenoxy]-hydroxyphosphoryl]oxy-5-(2,4-dioxopyrimidin-1-yl)-4-(methylamino)oxolan-2-yl]methyl 2,2-dimethylpropanoate;[(2R,5R)-5-(2,4-dioxopyrimidin-1-yl)-3-[2-(2,5-dioxopyrrolidin-1-yl)oxycarbonyloxyethoxy-methoxyphosphoryl]oxy-4-(methylamino)oxolan-2-yl]methyl 2,2-dimethylpropanoate;[(2R,5R)-5-(2,4-dioxopyrimidin-1-yl)-3-[2-ethoxycarbonyloxyethoxy(methoxy)phosphoryl]oxy-4-(methylamino)oxolan-2-yl]methyl 2,2-dimethylpropanoate;ethane-1,2-diol;methane;methanol
[(2R,5R)-4-amino-5-(2,4-dioxopyrimidin-1-yl)-3-[methoxy(phenyl)phosphoryl]oxyoxolan-2-yl]methyl 2,2-dimethylpropanoate;[(2R,5R)-3-[2-[bis(4-methoxyphenyl)-phenylmethoxy]ethoxy-methoxyphosphoryl]oxy-5-(2,4-dioxopyrimidin-1-yl)-4-(methylamino)oxolan-2-yl]methyl 2,2-dimethylpropanoate;[(2R,5R)-3-[[4-[[bis(4-methoxyphenyl)-phenylmethoxy]methyl]phenoxy]-hydroxyphosphoryl]oxy-5-(2,4-dioxopyrimidin-1-yl)-4-(methylamino)oxolan-2-yl]methyl 2,2-dimethylpropanoate;[(2R,5R)-5-(2,4-dioxopyrimidin-1-yl)-3-[2-(2,5-dioxopyrrolidin-1-yl)oxycarbonyloxyethoxy-methoxyphosphoryl]oxy-4-(methylamino)oxolan-2-yl]methyl 2,2-dimethylpropanoate;[(2R,5R)-5-(2,4-dioxopyrimidin-1-yl)-3-[2-ethoxycarbonyloxyethoxy(methoxy)phosphoryl]oxy-4-(methylamino)oxolan-2-yl]methyl 2,2-dimethylpropanoate;ethane-1,2-diol;methane;methanol (PubChem CID 158479974) has the molecular formula C155H221N16O61P5
and a molecular weight of 3439.39 g/mol. Its IUPAC name is [(2R,5R)-4-amino-5-(2,4-dioxopyrimidin-1-yl)-3-[methoxy(phenyl)phosphoryl]oxyoxolan-2-yl]methyl 2,2-dimethylpropanoate;[(2R,5R)-3-[2-[bis(4-methoxyphenyl)-phenylmethoxy]ethoxy-methoxyphosphoryl]oxy-5-(2,4-dioxopyrimidin-1-yl)-4-(methylamino)oxolan-2-yl]methyl 2,2-dimethylpropanoate;[(2R,5R)-3-[[4-[[bis(4-methoxyphenyl)-phenylmethoxy]methyl]phenoxy]-hydroxyphosphoryl]oxy-5-(2,4-dioxopyrimidin-1-yl)-4-(methylamino)oxolan-2-yl]methyl 2,2-dimethylpropanoate;[(2R,5R)-5-(2,4-dioxopyrimidin-1-yl)-3-[2-(2,5-dioxopyrrolidin-1-yl)oxycarbonyloxyethoxy-methoxyphosphoryl]oxy-4-(methylamino)oxolan-2-yl]methyl 2,2-dimethylpropanoate;[(2R,5R)-5-(2,4-dioxopyrimidin-1-yl)-3-[2-ethoxycarbonyloxyethoxy(methoxy)phosphoryl]oxy-4-(methylamino)oxolan-2-yl]methyl 2,2-dimethylpropanoate;ethane-1,2-diol;methane;methanol.
Frequently Asked Questions
What is the IUPAC name of [(2R,5R)-4-amino-5-(2,4-dioxopyrimidin-1-yl)-3-[methoxy(phenyl)phosphoryl]oxyoxolan-2-yl]methyl 2,2-dimethylpropanoate;[(2R,5R)-3-[2-[bis(4-methoxyphenyl)-phenylmethoxy]ethoxy-methoxyphosphoryl]oxy-5-(2,4-dioxopyrimidin-1-yl)-4-(methylamino)oxolan-2-yl]methyl 2,2-dimethylpropanoate;[(2R,5R)-3-[[4-[[bis(4-methoxyphenyl)-phenylmethoxy]methyl]phenoxy]-hydroxyphosphoryl]oxy-5-(2,4-dioxopyrimidin-1-yl)-4-(methylamino)oxolan-2-yl]methyl 2,2-dimethylpropanoate;[(2R,5R)-5-(2,4-dioxopyrimidin-1-yl)-3-[2-(2,5-dioxopyrrolidin-1-yl)oxycarbonyloxyethoxy-methoxyphosphoryl]oxy-4-(methylamino)oxolan-2-yl]methyl 2,2-dimethylpropanoate;[(2R,5R)-5-(2,4-dioxopyrimidin-1-yl)-3-[2-ethoxycarbonyloxyethoxy(methoxy)phosphoryl]oxy-4-(methylamino)oxolan-2-yl]methyl 2,2-dimethylpropanoate;ethane-1,2-diol;methane;methanol?
The IUPAC name of [(2R,5R)-4-amino-5-(2,4-dioxopyrimidin-1-yl)-3-[methoxy(phenyl)phosphoryl]oxyoxolan-2-yl]methyl 2,2-dimethylpropanoate;[(2R,5R)-3-[2-[bis(4-methoxyphenyl)-phenylmethoxy]ethoxy-methoxyphosphoryl]oxy-5-(2,4-dioxopyrimidin-1-yl)-4-(methylamino)oxolan-2-yl]methyl 2,2-dimethylpropanoate;[(2R,5R)-3-[[4-[[bis(4-methoxyphenyl)-phenylmethoxy]methyl]phenoxy]-hydroxyphosphoryl]oxy-5-(2,4-dioxopyrimidin-1-yl)-4-(methylamino)oxolan-2-yl]methyl 2,2-dimethylpropanoate;[(2R,5R)-5-(2,4-dioxopyrimidin-1-yl)-3-[2-(2,5-dioxopyrrolidin-1-yl)oxycarbonyloxyethoxy-methoxyphosphoryl]oxy-4-(methylamino)oxolan-2-yl]methyl 2,2-dimethylpropanoate;[(2R,5R)-5-(2,4-dioxopyrimidin-1-yl)-3-[2-ethoxycarbonyloxyethoxy(methoxy)phosphoryl]oxy-4-(methylamino)oxolan-2-yl]methyl 2,2-dimethylpropanoate;ethane-1,2-diol;methane;methanol (CID 158479974) is [(2R,5R)-4-amino-5-(2,4-dioxopyrimidin-1-yl)-3-[methoxy(phenyl)phosphoryl]oxyoxolan-2-yl]methyl 2,2-dimethylpropanoate;[(2R,5R)-3-[2-[bis(4-methoxyphenyl)-phenylmethoxy]ethoxy-methoxyphosphoryl]oxy-5-(2,4-dioxopyrimidin-1-yl)-4-(methylamino)oxolan-2-yl]methyl 2,2-dimethylpropanoate;[(2R,5R)-3-[[4-[[bis(4-methoxyphenyl)-phenylmethoxy]methyl]phenoxy]-hydroxyphosphoryl]oxy-5-(2,4-dioxopyrimidin-1-yl)-4-(methylamino)oxolan-2-yl]methyl 2,2-dimethylpropanoate;[(2R,5R)-5-(2,4-dioxopyrimidin-1-yl)-3-[2-(2,5-dioxopyrrolidin-1-yl)oxycarbonyloxyethoxy-methoxyphosphoryl]oxy-4-(methylamino)oxolan-2-yl]methyl 2,2-dimethylpropanoate;[(2R,5R)-5-(2,4-dioxopyrimidin-1-yl)-3-[2-ethoxycarbonyloxyethoxy(methoxy)phosphoryl]oxy-4-(methylamino)oxolan-2-yl]methyl 2,2-dimethylpropanoate;ethane-1,2-diol;methane;methanol.
What is the SMILES notation for [(2R,5R)-4-amino-5-(2,4-dioxopyrimidin-1-yl)-3-[methoxy(phenyl)phosphoryl]oxyoxolan-2-yl]methyl 2,2-dimethylpropanoate;[(2R,5R)-3-[2-[bis(4-methoxyphenyl)-phenylmethoxy]ethoxy-methoxyphosphoryl]oxy-5-(2,4-dioxopyrimidin-1-yl)-4-(methylamino)oxolan-2-yl]methyl 2,2-dimethylpropanoate;[(2R,5R)-3-[[4-[[bis(4-methoxyphenyl)-phenylmethoxy]methyl]phenoxy]-hydroxyphosphoryl]oxy-5-(2,4-dioxopyrimidin-1-yl)-4-(methylamino)oxolan-2-yl]methyl 2,2-dimethylpropanoate;[(2R,5R)-5-(2,4-dioxopyrimidin-1-yl)-3-[2-(2,5-dioxopyrrolidin-1-yl)oxycarbonyloxyethoxy-methoxyphosphoryl]oxy-4-(methylamino)oxolan-2-yl]methyl 2,2-dimethylpropanoate;[(2R,5R)-5-(2,4-dioxopyrimidin-1-yl)-3-[2-ethoxycarbonyloxyethoxy(methoxy)phosphoryl]oxy-4-(methylamino)oxolan-2-yl]methyl 2,2-dimethylpropanoate;ethane-1,2-diol;methane;methanol?
The canonical SMILES for [(2R,5R)-4-amino-5-(2,4-dioxopyrimidin-1-yl)-3-[methoxy(phenyl)phosphoryl]oxyoxolan-2-yl]methyl 2,2-dimethylpropanoate;[(2R,5R)-3-[2-[bis(4-methoxyphenyl)-phenylmethoxy]ethoxy-methoxyphosphoryl]oxy-5-(2,4-dioxopyrimidin-1-yl)-4-(methylamino)oxolan-2-yl]methyl 2,2-dimethylpropanoate;[(2R,5R)-3-[[4-[[bis(4-methoxyphenyl)-phenylmethoxy]methyl]phenoxy]-hydroxyphosphoryl]oxy-5-(2,4-dioxopyrimidin-1-yl)-4-(methylamino)oxolan-2-yl]methyl 2,2-dimethylpropanoate;[(2R,5R)-5-(2,4-dioxopyrimidin-1-yl)-3-[2-(2,5-dioxopyrrolidin-1-yl)oxycarbonyloxyethoxy-methoxyphosphoryl]oxy-4-(methylamino)oxolan-2-yl]methyl 2,2-dimethylpropanoate;[(2R,5R)-5-(2,4-dioxopyrimidin-1-yl)-3-[2-ethoxycarbonyloxyethoxy(methoxy)phosphoryl]oxy-4-(methylamino)oxolan-2-yl]methyl 2,2-dimethylpropanoate;ethane-1,2-diol;methane;methanol is C.C.C.C.C.CCOC(=O)OCCOP(=O)(OC)OC1C(NC)[C@H](n2ccc(=O)[nH]c2=O)O[C@@H]1COC(=O)C(C)(C)C.CNC1C(OP(=O)(O)Oc2ccc(COC(c3ccccc3)(c3ccc(OC)cc3)c3ccc(OC)cc3)cc2)[C@@H](COC(=O)C(C)(C)C)O[C@H]1n1ccc(=O)[nH]c1=O.CNC1C(OP(=O)(OC)OCCOC(=O)ON2C(=O)CCC2=O)[C@@H](COC(=O)C(C)(C)C)O[C@H]1n1ccc(=O)[nH]c1=O.CNC1C(OP(=O)(OC)OCCOC(c2ccccc2)(c2ccc(OC)cc2)c2ccc(OC)cc2)[C@@H](COC(=O)C(C)(C)C)O[C@H]1n1ccc(=O)[nH]c1=O.CO.COP(=O)(OC1C(N)[C@H](n2ccc(=O)[nH]c2=O)O[C@@H]1COC(=O)C(C)(C)C)c1ccccc1.OCCO.
What is the InChIKey of [(2R,5R)-4-amino-5-(2,4-dioxopyrimidin-1-yl)-3-[methoxy(phenyl)phosphoryl]oxyoxolan-2-yl]methyl 2,2-dimethylpropanoate;[(2R,5R)-3-[2-[bis(4-methoxyphenyl)-phenylmethoxy]ethoxy-methoxyphosphoryl]oxy-5-(2,4-dioxopyrimidin-1-yl)-4-(methylamino)oxolan-2-yl]methyl 2,2-dimethylpropanoate;[(2R,5R)-3-[[4-[[bis(4-methoxyphenyl)-phenylmethoxy]methyl]phenoxy]-hydroxyphosphoryl]oxy-5-(2,4-dioxopyrimidin-1-yl)-4-(methylamino)oxolan-2-yl]methyl 2,2-dimethylpropanoate;[(2R,5R)-5-(2,4-dioxopyrimidin-1-yl)-3-[2-(2,5-dioxopyrrolidin-1-yl)oxycarbonyloxyethoxy-methoxyphosphoryl]oxy-4-(methylamino)oxolan-2-yl]methyl 2,2-dimethylpropanoate;[(2R,5R)-5-(2,4-dioxopyrimidin-1-yl)-3-[2-ethoxycarbonyloxyethoxy(methoxy)phosphoryl]oxy-4-(methylamino)oxolan-2-yl]methyl 2,2-dimethylpropanoate;ethane-1,2-diol;methane;methanol?
The InChIKey is HHKCRWBCMIGNDV-LUNPXGEESA-N. The full InChI is InChI=1S/C43H48N3O12P.C39H48N3O12P.C23H33N4O14P.C21H34N3O12P.C21H28N3O8P.C2H6O2.CH4O.5CH4/c1-42(2,3)40(48)54-27-35-38(37(44-4)39(56-35)46-25-24-36(47)45-41(46)49)58-59(50,51)57-34-18-12-28(13-19-34)26-55-43(29-10-8-7-9-11-29,30-14-20-32(52-5)21-15-30)31-16-22-33(53-6)23-17-31;1-38(2,3)36(44)50-25-31-34(33(40-4)35(53-31)42-22-21-32(43)41-37(42)45)54-55(46,49-7)52-24-23-51-39(26-11-9-8-10-12-26,27-13-17-29(47-5)18-14-27)28-15-19-30(48-6)20-16-28;1-23(2,3)20(31)37-12-13-18(17(24-4)19(39-13)26-9-8-14(28)25-21(26)32)41-42(34,35-5)38-11-10-36-22(33)40-27-15(29)6-7-16(27)30;1-7-31-20(28)32-10-11-34-37(29,30-6)36-16-13(12-33-18(26)21(2,3)4)35-17(15(16)22-5)24-9-8-14(25)23-19(24)27;1-21(2,3)19(26)30-12-14-17(32-33(28,29-4)13-8-6-5-7-9-13)16(22)18(31-14)24-11-10-15(25)23-20(24)27;3-1-2-4;1-2;;;;;/h7-25,35,37-39,44H,26-27H2,1-6H3,(H,50,51)(H,45,47,49);8-22,31,33-35,40H,23-25H2,1-7H3,(H,41,43,45);8-9,13,17-19,24H,6-7,10-12H2,1-5H3,(H,25,28,32);8-9,13,15-17,22H,7,10-12H2,1-6H3,(H,23,25,27);5-11,14,16-18H,12,22H2,1-4H3,(H,23,25,27);3-4H,1-2H2;2H,1H3;5*1H4/t35-,37?,38?,39-;31-,33?,34?,35-,55?;13-,17?,18?,19-,42?;13-,15?,16?,17-,37?;14-,16?,17?,18-,33?;;;;;;;/m11111......./s1.
What are the key properties of [(2R,5R)-4-amino-5-(2,4-dioxopyrimidin-1-yl)-3-[methoxy(phenyl)phosphoryl]oxyoxolan-2-yl]methyl 2,2-dimethylpropanoate;[(2R,5R)-3-[2-[bis(4-methoxyphenyl)-phenylmethoxy]ethoxy-methoxyphosphoryl]oxy-5-(2,4-dioxopyrimidin-1-yl)-4-(methylamino)oxolan-2-yl]methyl 2,2-dimethylpropanoate;[(2R,5R)-3-[[4-[[bis(4-methoxyphenyl)-phenylmethoxy]methyl]phenoxy]-hydroxyphosphoryl]oxy-5-(2,4-dioxopyrimidin-1-yl)-4-(methylamino)oxolan-2-yl]methyl 2,2-dimethylpropanoate;[(2R,5R)-5-(2,4-dioxopyrimidin-1-yl)-3-[2-(2,5-dioxopyrrolidin-1-yl)oxycarbonyloxyethoxy-methoxyphosphoryl]oxy-4-(methylamino)oxolan-2-yl]methyl 2,2-dimethylpropanoate;[(2R,5R)-5-(2,4-dioxopyrimidin-1-yl)-3-[2-ethoxycarbonyloxyethoxy(methoxy)phosphoryl]oxy-4-(methylamino)oxolan-2-yl]methyl 2,2-dimethylpropanoate;ethane-1,2-diol;methane;methanol?
[(2R,5R)-4-amino-5-(2,4-dioxopyrimidin-1-yl)-3-[methoxy(phenyl)phosphoryl]oxyoxolan-2-yl]methyl 2,2-dimethylpropanoate;[(2R,5R)-3-[2-[bis(4-methoxyphenyl)-phenylmethoxy]ethoxy-methoxyphosphoryl]oxy-5-(2,4-dioxopyrimidin-1-yl)-4-(methylamino)oxolan-2-yl]methyl 2,2-dimethylpropanoate;[(2R,5R)-3-[[4-[[bis(4-methoxyphenyl)-phenylmethoxy]methyl]phenoxy]-hydroxyphosphoryl]oxy-5-(2,4-dioxopyrimidin-1-yl)-4-(methylamino)oxolan-2-yl]methyl 2,2-dimethylpropanoate;[(2R,5R)-5-(2,4-dioxopyrimidin-1-yl)-3-[2-(2,5-dioxopyrrolidin-1-yl)oxycarbonyloxyethoxy-methoxyphosphoryl]oxy-4-(methylamino)oxolan-2-yl]methyl 2,2-dimethylpropanoate;[(2R,5R)-5-(2,4-dioxopyrimidin-1-yl)-3-[2-ethoxycarbonyloxyethoxy(methoxy)phosphoryl]oxy-4-(methylamino)oxolan-2-yl]methyl 2,2-dimethylpropanoate;ethane-1,2-diol;methane;methanol has a molecular weight of 3439.39 g/mol, XLogP of 14.08, 65 rotatable bonds, 14 hydrogen bond donors, and 70 hydrogen bond acceptors.
Where does this data come from?
All data for [(2R,5R)-4-amino-5-(2,4-dioxopyrimidin-1-yl)-3-[methoxy(phenyl)phosphoryl]oxyoxolan-2-yl]methyl 2,2-dimethylpropanoate;[(2R,5R)-3-[2-[bis(4-methoxyphenyl)-phenylmethoxy]ethoxy-methoxyphosphoryl]oxy-5-(2,4-dioxopyrimidin-1-yl)-4-(methylamino)oxolan-2-yl]methyl 2,2-dimethylpropanoate;[(2R,5R)-3-[[4-[[bis(4-methoxyphenyl)-phenylmethoxy]methyl]phenoxy]-hydroxyphosphoryl]oxy-5-(2,4-dioxopyrimidin-1-yl)-4-(methylamino)oxolan-2-yl]methyl 2,2-dimethylpropanoate;[(2R,5R)-5-(2,4-dioxopyrimidin-1-yl)-3-[2-(2,5-dioxopyrrolidin-1-yl)oxycarbonyloxyethoxy-methoxyphosphoryl]oxy-4-(methylamino)oxolan-2-yl]methyl 2,2-dimethylpropanoate;[(2R,5R)-5-(2,4-dioxopyrimidin-1-yl)-3-[2-ethoxycarbonyloxyethoxy(methoxy)phosphoryl]oxy-4-(methylamino)oxolan-2-yl]methyl 2,2-dimethylpropanoate;ethane-1,2-diol;methane;methanol is sourced from PubChem (CID 158479974), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).