About sodium;hydroxyazanide;[4-[4-(2-methoxy-2-oxoethyl)-2-(2-methylbut-3-enoylamino)phenyl]-6-[1-(methylamino)but-3-enyl]-2-pyridinyl] 2-methylbut-3-enoate;methyl 2-[3-amino-4-[2-[1-(methylamino)but-3-enyl]-6-oxo-1H-pyridin-4-yl]phenyl]acetate;methyl 2-(14-amino-10-methyl-9,17-dioxo-8,16-diazatricyclo[13.3.1.02,7]nonadeca-1(18),2(7),3,5,15(19)-pentaen-5-yl)acetate;methyl 2-[4-[2-[1-(methylamino)but-3-enyl]-6-oxo-1H-pyridin-4-yl]-3-(2-methylbut-3-enoylamino)phenyl]acetate;methyl 2-[10-methyl-14-(methylamino)-9,17-dioxo-8,16-diazatricyclo[13.3.1.02,7]nonadeca-1(18),2(7),3,5,11,15(19)-hexaen-5-yl]acetate;methyl 2-[10-methyl-14-(methylamino)-9,17-dioxo-8,16-diazatricyclo[13.3.1.02,7]nonadeca-1(18),2(7),3,5,15(19)-pentaen-5-yl]acetate;2-methylpropoxycarbonyl 2-methylbut-3-enoate;molecular hydrogen
sodium;hydroxyazanide;[4-[4-(2-methoxy-2-oxoethyl)-2-(2-methylbut-3-enoylamino)phenyl]-6-[1-(methylamino)but-3-enyl]-2-pyridinyl] 2-methylbut-3-enoate;methyl 2-[3-amino-4-[2-[1-(methylamino)but-3-enyl]-6-oxo-1H-pyridin-4-yl]phenyl]acetate;methyl 2-(14-amino-10-methyl-9,17-dioxo-8,16-diazatricyclo[13.3.1.02,7]nonadeca-1(18),2(7),3,5,15(19)-pentaen-5-yl)acetate;methyl 2-[4-[2-[1-(methylamino)but-3-enyl]-6-oxo-1H-pyridin-4-yl]-3-(2-methylbut-3-enoylamino)phenyl]acetate;methyl 2-[10-methyl-14-(methylamino)-9,17-dioxo-8,16-diazatricyclo[13.3.1.02,7]nonadeca-1(18),2(7),3,5,11,15(19)-hexaen-5-yl]acetate;methyl 2-[10-methyl-14-(methylamino)-9,17-dioxo-8,16-diazatricyclo[13.3.1.02,7]nonadeca-1(18),2(7),3,5,15(19)-pentaen-5-yl]acetate;2-methylpropoxycarbonyl 2-methylbut-3-enoate;molecular hydrogen (PubChem CID 157409208) has the molecular formula C147H184N19NaO29
and a molecular weight of 2704.18 g/mol. Its IUPAC name is sodium;hydroxyazanide;[4-[4-(2-methoxy-2-oxoethyl)-2-(2-methylbut-3-enoylamino)phenyl]-6-[1-(methylamino)but-3-enyl]-2-pyridinyl] 2-methylbut-3-enoate;methyl 2-[3-amino-4-[2-[1-(methylamino)but-3-enyl]-6-oxo-1H-pyridin-4-yl]phenyl]acetate;methyl 2-(14-amino-10-methyl-9,17-dioxo-8,16-diazatricyclo[13.3.1.02,7]nonadeca-1(18),2(7),3,5,15(19)-pentaen-5-yl)acetate;methyl 2-[4-[2-[1-(methylamino)but-3-enyl]-6-oxo-1H-pyridin-4-yl]-3-(2-methylbut-3-enoylamino)phenyl]acetate;methyl 2-[10-methyl-14-(methylamino)-9,17-dioxo-8,16-diazatricyclo[13.3.1.02,7]nonadeca-1(18),2(7),3,5,11,15(19)-hexaen-5-yl]acetate;methyl 2-[10-methyl-14-(methylamino)-9,17-dioxo-8,16-diazatricyclo[13.3.1.02,7]nonadeca-1(18),2(7),3,5,15(19)-pentaen-5-yl]acetate;2-methylpropoxycarbonyl 2-methylbut-3-enoate;molecular hydrogen.
Frequently Asked Questions
What is the IUPAC name of sodium;hydroxyazanide;[4-[4-(2-methoxy-2-oxoethyl)-2-(2-methylbut-3-enoylamino)phenyl]-6-[1-(methylamino)but-3-enyl]-2-pyridinyl] 2-methylbut-3-enoate;methyl 2-[3-amino-4-[2-[1-(methylamino)but-3-enyl]-6-oxo-1H-pyridin-4-yl]phenyl]acetate;methyl 2-(14-amino-10-methyl-9,17-dioxo-8,16-diazatricyclo[13.3.1.02,7]nonadeca-1(18),2(7),3,5,15(19)-pentaen-5-yl)acetate;methyl 2-[4-[2-[1-(methylamino)but-3-enyl]-6-oxo-1H-pyridin-4-yl]-3-(2-methylbut-3-enoylamino)phenyl]acetate;methyl 2-[10-methyl-14-(methylamino)-9,17-dioxo-8,16-diazatricyclo[13.3.1.02,7]nonadeca-1(18),2(7),3,5,11,15(19)-hexaen-5-yl]acetate;methyl 2-[10-methyl-14-(methylamino)-9,17-dioxo-8,16-diazatricyclo[13.3.1.02,7]nonadeca-1(18),2(7),3,5,15(19)-pentaen-5-yl]acetate;2-methylpropoxycarbonyl 2-methylbut-3-enoate;molecular hydrogen?
The IUPAC name of sodium;hydroxyazanide;[4-[4-(2-methoxy-2-oxoethyl)-2-(2-methylbut-3-enoylamino)phenyl]-6-[1-(methylamino)but-3-enyl]-2-pyridinyl] 2-methylbut-3-enoate;methyl 2-[3-amino-4-[2-[1-(methylamino)but-3-enyl]-6-oxo-1H-pyridin-4-yl]phenyl]acetate;methyl 2-(14-amino-10-methyl-9,17-dioxo-8,16-diazatricyclo[13.3.1.02,7]nonadeca-1(18),2(7),3,5,15(19)-pentaen-5-yl)acetate;methyl 2-[4-[2-[1-(methylamino)but-3-enyl]-6-oxo-1H-pyridin-4-yl]-3-(2-methylbut-3-enoylamino)phenyl]acetate;methyl 2-[10-methyl-14-(methylamino)-9,17-dioxo-8,16-diazatricyclo[13.3.1.02,7]nonadeca-1(18),2(7),3,5,11,15(19)-hexaen-5-yl]acetate;methyl 2-[10-methyl-14-(methylamino)-9,17-dioxo-8,16-diazatricyclo[13.3.1.02,7]nonadeca-1(18),2(7),3,5,15(19)-pentaen-5-yl]acetate;2-methylpropoxycarbonyl 2-methylbut-3-enoate;molecular hydrogen (CID 157409208) is sodium;hydroxyazanide;[4-[4-(2-methoxy-2-oxoethyl)-2-(2-methylbut-3-enoylamino)phenyl]-6-[1-(methylamino)but-3-enyl]-2-pyridinyl] 2-methylbut-3-enoate;methyl 2-[3-amino-4-[2-[1-(methylamino)but-3-enyl]-6-oxo-1H-pyridin-4-yl]phenyl]acetate;methyl 2-(14-amino-10-methyl-9,17-dioxo-8,16-diazatricyclo[13.3.1.02,7]nonadeca-1(18),2(7),3,5,15(19)-pentaen-5-yl)acetate;methyl 2-[4-[2-[1-(methylamino)but-3-enyl]-6-oxo-1H-pyridin-4-yl]-3-(2-methylbut-3-enoylamino)phenyl]acetate;methyl 2-[10-methyl-14-(methylamino)-9,17-dioxo-8,16-diazatricyclo[13.3.1.02,7]nonadeca-1(18),2(7),3,5,11,15(19)-hexaen-5-yl]acetate;methyl 2-[10-methyl-14-(methylamino)-9,17-dioxo-8,16-diazatricyclo[13.3.1.02,7]nonadeca-1(18),2(7),3,5,15(19)-pentaen-5-yl]acetate;2-methylpropoxycarbonyl 2-methylbut-3-enoate;molecular hydrogen.
What is the SMILES notation for sodium;hydroxyazanide;[4-[4-(2-methoxy-2-oxoethyl)-2-(2-methylbut-3-enoylamino)phenyl]-6-[1-(methylamino)but-3-enyl]-2-pyridinyl] 2-methylbut-3-enoate;methyl 2-[3-amino-4-[2-[1-(methylamino)but-3-enyl]-6-oxo-1H-pyridin-4-yl]phenyl]acetate;methyl 2-(14-amino-10-methyl-9,17-dioxo-8,16-diazatricyclo[13.3.1.02,7]nonadeca-1(18),2(7),3,5,15(19)-pentaen-5-yl)acetate;methyl 2-[4-[2-[1-(methylamino)but-3-enyl]-6-oxo-1H-pyridin-4-yl]-3-(2-methylbut-3-enoylamino)phenyl]acetate;methyl 2-[10-methyl-14-(methylamino)-9,17-dioxo-8,16-diazatricyclo[13.3.1.02,7]nonadeca-1(18),2(7),3,5,11,15(19)-hexaen-5-yl]acetate;methyl 2-[10-methyl-14-(methylamino)-9,17-dioxo-8,16-diazatricyclo[13.3.1.02,7]nonadeca-1(18),2(7),3,5,15(19)-pentaen-5-yl]acetate;2-methylpropoxycarbonyl 2-methylbut-3-enoate;molecular hydrogen?
The canonical SMILES for sodium;hydroxyazanide;[4-[4-(2-methoxy-2-oxoethyl)-2-(2-methylbut-3-enoylamino)phenyl]-6-[1-(methylamino)but-3-enyl]-2-pyridinyl] 2-methylbut-3-enoate;methyl 2-[3-amino-4-[2-[1-(methylamino)but-3-enyl]-6-oxo-1H-pyridin-4-yl]phenyl]acetate;methyl 2-(14-amino-10-methyl-9,17-dioxo-8,16-diazatricyclo[13.3.1.02,7]nonadeca-1(18),2(7),3,5,15(19)-pentaen-5-yl)acetate;methyl 2-[4-[2-[1-(methylamino)but-3-enyl]-6-oxo-1H-pyridin-4-yl]-3-(2-methylbut-3-enoylamino)phenyl]acetate;methyl 2-[10-methyl-14-(methylamino)-9,17-dioxo-8,16-diazatricyclo[13.3.1.02,7]nonadeca-1(18),2(7),3,5,11,15(19)-hexaen-5-yl]acetate;methyl 2-[10-methyl-14-(methylamino)-9,17-dioxo-8,16-diazatricyclo[13.3.1.02,7]nonadeca-1(18),2(7),3,5,15(19)-pentaen-5-yl]acetate;2-methylpropoxycarbonyl 2-methylbut-3-enoate;molecular hydrogen is C=CC(C)C(=O)OC(=O)OCC(C)C.C=CCC(NC)c1cc(-c2ccc(CC(=O)OC)cc2N)cc(=O)[nH]1.C=CCC(NC)c1cc(-c2ccc(CC(=O)OC)cc2NC(=O)C(C)C=C)cc(=O)[nH]1.C=CCC(NC)c1cc(-c2ccc(CC(=O)OC)cc2NC(=O)C(C)C=C)cc(OC(=O)C(C)C=C)n1.CNC1CC=CC(C)C(=O)Nc2cc(CC(=O)OC)ccc2-c2cc1[nH]c(=O)c2.CNC1CCCC(C)C(=O)Nc2cc(CC(=O)OC)ccc2-c2cc1[nH]c(=O)c2.COC(=O)Cc1ccc2c(c1)NC(=O)C(C)CCCC(N)c1cc-2cc(=O)[nH]1.[H][H].[NH-]O.[Na+].
What is the InChIKey of sodium;hydroxyazanide;[4-[4-(2-methoxy-2-oxoethyl)-2-(2-methylbut-3-enoylamino)phenyl]-6-[1-(methylamino)but-3-enyl]-2-pyridinyl] 2-methylbut-3-enoate;methyl 2-[3-amino-4-[2-[1-(methylamino)but-3-enyl]-6-oxo-1H-pyridin-4-yl]phenyl]acetate;methyl 2-(14-amino-10-methyl-9,17-dioxo-8,16-diazatricyclo[13.3.1.02,7]nonadeca-1(18),2(7),3,5,15(19)-pentaen-5-yl)acetate;methyl 2-[4-[2-[1-(methylamino)but-3-enyl]-6-oxo-1H-pyridin-4-yl]-3-(2-methylbut-3-enoylamino)phenyl]acetate;methyl 2-[10-methyl-14-(methylamino)-9,17-dioxo-8,16-diazatricyclo[13.3.1.02,7]nonadeca-1(18),2(7),3,5,11,15(19)-hexaen-5-yl]acetate;methyl 2-[10-methyl-14-(methylamino)-9,17-dioxo-8,16-diazatricyclo[13.3.1.02,7]nonadeca-1(18),2(7),3,5,15(19)-pentaen-5-yl]acetate;2-methylpropoxycarbonyl 2-methylbut-3-enoate;molecular hydrogen?
The InChIKey is BOBSVDJNVKXUSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C29H35N3O5.C24H29N3O4.C22H27N3O4.C22H25N3O4.C21H25N3O4.C19H23N3O3.C10H16O4.H2NO.Na.H2/c1-8-11-23(30-6)25-16-21(17-26(31-25)37-29(35)19(5)10-3)22-13-12-20(15-27(33)36-7)14-24(22)32-28(34)18(4)9-2;1-6-8-19(25-4)21-13-17(14-22(28)26-21)18-10-9-16(12-23(29)31-5)11-20(18)27-24(30)15(3)7-2;2*1-13-5-4-6-17(23-2)19-11-15(12-20(26)24-19)16-8-7-14(10-21(27)29-3)9-18(16)25-22(13)28;1-12-4-3-5-16(22)18-10-14(11-19(25)23-18)15-7-6-13(9-20(26)28-2)8-17(15)24-21(12)27;1-4-5-16(21-2)17-10-13(11-18(23)22-17)14-7-6-12(8-15(14)20)9-19(24)25-3;1-5-8(4)9(11)14-10(12)13-6-7(2)3;1-2;;/h8-10,12-14,16-19,23,30H,1-3,11,15H2,4-7H3,(H,32,34);6-7,9-11,13-15,19,25H,1-2,8,12H2,3-5H3,(H,26,28)(H,27,30);7-9,11-13,17,23H,4-6,10H2,1-3H3,(H,24,26)(H,25,28);4-5,7-9,11-13,17,23H,6,10H2,1-3H3,(H,24,26)(H,25,28);6-8,10-12,16H,3-5,9,22H2,1-2H3,(H,23,25)(H,24,27);4,6-8,10-11,16,21H,1,5,9,20H2,2-3H3,(H,22,23);5,7-8H,1,6H2,2-4H3;1-2H;;1H/q;;;;;;;-1;+1;.
What are the key properties of sodium;hydroxyazanide;[4-[4-(2-methoxy-2-oxoethyl)-2-(2-methylbut-3-enoylamino)phenyl]-6-[1-(methylamino)but-3-enyl]-2-pyridinyl] 2-methylbut-3-enoate;methyl 2-[3-amino-4-[2-[1-(methylamino)but-3-enyl]-6-oxo-1H-pyridin-4-yl]phenyl]acetate;methyl 2-(14-amino-10-methyl-9,17-dioxo-8,16-diazatricyclo[13.3.1.02,7]nonadeca-1(18),2(7),3,5,15(19)-pentaen-5-yl)acetate;methyl 2-[4-[2-[1-(methylamino)but-3-enyl]-6-oxo-1H-pyridin-4-yl]-3-(2-methylbut-3-enoylamino)phenyl]acetate;methyl 2-[10-methyl-14-(methylamino)-9,17-dioxo-8,16-diazatricyclo[13.3.1.02,7]nonadeca-1(18),2(7),3,5,11,15(19)-hexaen-5-yl]acetate;methyl 2-[10-methyl-14-(methylamino)-9,17-dioxo-8,16-diazatricyclo[13.3.1.02,7]nonadeca-1(18),2(7),3,5,15(19)-pentaen-5-yl]acetate;2-methylpropoxycarbonyl 2-methylbut-3-enoate;molecular hydrogen?
sodium;hydroxyazanide;[4-[4-(2-methoxy-2-oxoethyl)-2-(2-methylbut-3-enoylamino)phenyl]-6-[1-(methylamino)but-3-enyl]-2-pyridinyl] 2-methylbut-3-enoate;methyl 2-[3-amino-4-[2-[1-(methylamino)but-3-enyl]-6-oxo-1H-pyridin-4-yl]phenyl]acetate;methyl 2-(14-amino-10-methyl-9,17-dioxo-8,16-diazatricyclo[13.3.1.02,7]nonadeca-1(18),2(7),3,5,15(19)-pentaen-5-yl)acetate;methyl 2-[4-[2-[1-(methylamino)but-3-enyl]-6-oxo-1H-pyridin-4-yl]-3-(2-methylbut-3-enoylamino)phenyl]acetate;methyl 2-[10-methyl-14-(methylamino)-9,17-dioxo-8,16-diazatricyclo[13.3.1.02,7]nonadeca-1(18),2(7),3,5,11,15(19)-hexaen-5-yl]acetate;methyl 2-[10-methyl-14-(methylamino)-9,17-dioxo-8,16-diazatricyclo[13.3.1.02,7]nonadeca-1(18),2(7),3,5,15(19)-pentaen-5-yl]acetate;2-methylpropoxycarbonyl 2-methylbut-3-enoate;molecular hydrogen has a molecular weight of 2704.18 g/mol, XLogP of 17.99, 42 rotatable bonds, 18 hydrogen bond donors, and 37 hydrogen bond acceptors.
Where does this data come from?
All data for sodium;hydroxyazanide;[4-[4-(2-methoxy-2-oxoethyl)-2-(2-methylbut-3-enoylamino)phenyl]-6-[1-(methylamino)but-3-enyl]-2-pyridinyl] 2-methylbut-3-enoate;methyl 2-[3-amino-4-[2-[1-(methylamino)but-3-enyl]-6-oxo-1H-pyridin-4-yl]phenyl]acetate;methyl 2-(14-amino-10-methyl-9,17-dioxo-8,16-diazatricyclo[13.3.1.02,7]nonadeca-1(18),2(7),3,5,15(19)-pentaen-5-yl)acetate;methyl 2-[4-[2-[1-(methylamino)but-3-enyl]-6-oxo-1H-pyridin-4-yl]-3-(2-methylbut-3-enoylamino)phenyl]acetate;methyl 2-[10-methyl-14-(methylamino)-9,17-dioxo-8,16-diazatricyclo[13.3.1.02,7]nonadeca-1(18),2(7),3,5,11,15(19)-hexaen-5-yl]acetate;methyl 2-[10-methyl-14-(methylamino)-9,17-dioxo-8,16-diazatricyclo[13.3.1.02,7]nonadeca-1(18),2(7),3,5,15(19)-pentaen-5-yl]acetate;2-methylpropoxycarbonyl 2-methylbut-3-enoate;molecular hydrogen is sourced from PubChem (CID 157409208), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).