About lithium;[(2S,3S,4S,5R,6R)-3-acetyloxy-2-[9-(2,5-dioxopyrrolidin-1-yl)oxycarbonyloxynonoxy]-6-ethyl-5-methyloxan-4-yl] acetate;bis(2,5-dioxopyrrolidin-1-yl) carbonate;[(2S,3R,4S,5S,6S)-4,5-diacetyloxy-6-[9-[[(1R,15S,17S)-17-ethyl-3,13-diazapentacyclo[13.3.1.02,10.04,9.013,18]nonadeca-2(10),4(9),5,7-tetraen-7-yl]oxycarbonyloxy]nonoxy]-3-methyloxan-2-yl]methyl acetate;[(2S,3R,4S,5S,6S)-4,5-diacetyloxy-6-(9-hydroxynonoxy)-3-methyloxan-2-yl]methyl acetate;(1R,15S,17S)-17-ethyl-3,13-diazapentacyclo[13.3.1.02,10.04,9.013,18]nonadeca-2(10),4(9),5,7-tetraen-7-ol;[(1R,15S,17S)-17-ethyl-3,13-diazapentacyclo[13.3.1.02,10.04,9.013,18]nonadeca-2(10),4(9),5,7-tetraen-7-yl] 9-[(2S,3S,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxynonyl carbonate;nonane-1,9-diol;tetrachlorostannane;[(2S,3R,4S,5S,6R)-4,5,6-triacetyloxy-3-methyloxan-2-yl]methyl acetate;hydroxide;hydrochloride
lithium;[(2S,3S,4S,5R,6R)-3-acetyloxy-2-[9-(2,5-dioxopyrrolidin-1-yl)oxycarbonyloxynonoxy]-6-ethyl-5-methyloxan-4-yl] acetate;bis(2,5-dioxopyrrolidin-1-yl) carbonate;[(2S,3R,4S,5S,6S)-4,5-diacetyloxy-6-[9-[[(1R,15S,17S)-17-ethyl-3,13-diazapentacyclo[13.3.1.02,10.04,9.013,18]nonadeca-2(10),4(9),5,7-tetraen-7-yl]oxycarbonyloxy]nonoxy]-3-methyloxan-2-yl]methyl acetate;[(2S,3R,4S,5S,6S)-4,5-diacetyloxy-6-(9-hydroxynonoxy)-3-methyloxan-2-yl]methyl acetate;(1R,15S,17S)-17-ethyl-3,13-diazapentacyclo[13.3.1.02,10.04,9.013,18]nonadeca-2(10),4(9),5,7-tetraen-7-ol;[(1R,15S,17S)-17-ethyl-3,13-diazapentacyclo[13.3.1.02,10.04,9.013,18]nonadeca-2(10),4(9),5,7-tetraen-7-yl] 9-[(2S,3S,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxynonyl carbonate;nonane-1,9-diol;tetrachlorostannane;[(2S,3R,4S,5S,6R)-4,5,6-triacetyloxy-3-methyloxan-2-yl]methyl acetate;hydroxide;hydrochloride (PubChem CID 158401848) has the molecular formula C177H267Cl5LiN9O60Sn
and a molecular weight of 3784.00 g/mol. Its IUPAC name is lithium;[(2S,3S,4S,5R,6R)-3-acetyloxy-2-[9-(2,5-dioxopyrrolidin-1-yl)oxycarbonyloxynonoxy]-6-ethyl-5-methyloxan-4-yl] acetate;bis(2,5-dioxopyrrolidin-1-yl) carbonate;[(2S,3R,4S,5S,6S)-4,5-diacetyloxy-6-[9-[[(1R,15S,17S)-17-ethyl-3,13-diazapentacyclo[13.3.1.02,10.04,9.013,18]nonadeca-2(10),4(9),5,7-tetraen-7-yl]oxycarbonyloxy]nonoxy]-3-methyloxan-2-yl]methyl acetate;[(2S,3R,4S,5S,6S)-4,5-diacetyloxy-6-(9-hydroxynonoxy)-3-methyloxan-2-yl]methyl acetate;(1R,15S,17S)-17-ethyl-3,13-diazapentacyclo[13.3.1.02,10.04,9.013,18]nonadeca-2(10),4(9),5,7-tetraen-7-ol;[(1R,15S,17S)-17-ethyl-3,13-diazapentacyclo[13.3.1.02,10.04,9.013,18]nonadeca-2(10),4(9),5,7-tetraen-7-yl] 9-[(2S,3S,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxynonyl carbonate;nonane-1,9-diol;tetrachlorostannane;[(2S,3R,4S,5S,6R)-4,5,6-triacetyloxy-3-methyloxan-2-yl]methyl acetate;hydroxide;hydrochloride.
Frequently Asked Questions
What is the IUPAC name of lithium;[(2S,3S,4S,5R,6R)-3-acetyloxy-2-[9-(2,5-dioxopyrrolidin-1-yl)oxycarbonyloxynonoxy]-6-ethyl-5-methyloxan-4-yl] acetate;bis(2,5-dioxopyrrolidin-1-yl) carbonate;[(2S,3R,4S,5S,6S)-4,5-diacetyloxy-6-[9-[[(1R,15S,17S)-17-ethyl-3,13-diazapentacyclo[13.3.1.02,10.04,9.013,18]nonadeca-2(10),4(9),5,7-tetraen-7-yl]oxycarbonyloxy]nonoxy]-3-methyloxan-2-yl]methyl acetate;[(2S,3R,4S,5S,6S)-4,5-diacetyloxy-6-(9-hydroxynonoxy)-3-methyloxan-2-yl]methyl acetate;(1R,15S,17S)-17-ethyl-3,13-diazapentacyclo[13.3.1.02,10.04,9.013,18]nonadeca-2(10),4(9),5,7-tetraen-7-ol;[(1R,15S,17S)-17-ethyl-3,13-diazapentacyclo[13.3.1.02,10.04,9.013,18]nonadeca-2(10),4(9),5,7-tetraen-7-yl] 9-[(2S,3S,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxynonyl carbonate;nonane-1,9-diol;tetrachlorostannane;[(2S,3R,4S,5S,6R)-4,5,6-triacetyloxy-3-methyloxan-2-yl]methyl acetate;hydroxide;hydrochloride?
The IUPAC name of lithium;[(2S,3S,4S,5R,6R)-3-acetyloxy-2-[9-(2,5-dioxopyrrolidin-1-yl)oxycarbonyloxynonoxy]-6-ethyl-5-methyloxan-4-yl] acetate;bis(2,5-dioxopyrrolidin-1-yl) carbonate;[(2S,3R,4S,5S,6S)-4,5-diacetyloxy-6-[9-[[(1R,15S,17S)-17-ethyl-3,13-diazapentacyclo[13.3.1.02,10.04,9.013,18]nonadeca-2(10),4(9),5,7-tetraen-7-yl]oxycarbonyloxy]nonoxy]-3-methyloxan-2-yl]methyl acetate;[(2S,3R,4S,5S,6S)-4,5-diacetyloxy-6-(9-hydroxynonoxy)-3-methyloxan-2-yl]methyl acetate;(1R,15S,17S)-17-ethyl-3,13-diazapentacyclo[13.3.1.02,10.04,9.013,18]nonadeca-2(10),4(9),5,7-tetraen-7-ol;[(1R,15S,17S)-17-ethyl-3,13-diazapentacyclo[13.3.1.02,10.04,9.013,18]nonadeca-2(10),4(9),5,7-tetraen-7-yl] 9-[(2S,3S,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxynonyl carbonate;nonane-1,9-diol;tetrachlorostannane;[(2S,3R,4S,5S,6R)-4,5,6-triacetyloxy-3-methyloxan-2-yl]methyl acetate;hydroxide;hydrochloride (CID 158401848) is lithium;[(2S,3S,4S,5R,6R)-3-acetyloxy-2-[9-(2,5-dioxopyrrolidin-1-yl)oxycarbonyloxynonoxy]-6-ethyl-5-methyloxan-4-yl] acetate;bis(2,5-dioxopyrrolidin-1-yl) carbonate;[(2S,3R,4S,5S,6S)-4,5-diacetyloxy-6-[9-[[(1R,15S,17S)-17-ethyl-3,13-diazapentacyclo[13.3.1.02,10.04,9.013,18]nonadeca-2(10),4(9),5,7-tetraen-7-yl]oxycarbonyloxy]nonoxy]-3-methyloxan-2-yl]methyl acetate;[(2S,3R,4S,5S,6S)-4,5-diacetyloxy-6-(9-hydroxynonoxy)-3-methyloxan-2-yl]methyl acetate;(1R,15S,17S)-17-ethyl-3,13-diazapentacyclo[13.3.1.02,10.04,9.013,18]nonadeca-2(10),4(9),5,7-tetraen-7-ol;[(1R,15S,17S)-17-ethyl-3,13-diazapentacyclo[13.3.1.02,10.04,9.013,18]nonadeca-2(10),4(9),5,7-tetraen-7-yl] 9-[(2S,3S,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxynonyl carbonate;nonane-1,9-diol;tetrachlorostannane;[(2S,3R,4S,5S,6R)-4,5,6-triacetyloxy-3-methyloxan-2-yl]methyl acetate;hydroxide;hydrochloride.
What is the SMILES notation for lithium;[(2S,3S,4S,5R,6R)-3-acetyloxy-2-[9-(2,5-dioxopyrrolidin-1-yl)oxycarbonyloxynonoxy]-6-ethyl-5-methyloxan-4-yl] acetate;bis(2,5-dioxopyrrolidin-1-yl) carbonate;[(2S,3R,4S,5S,6S)-4,5-diacetyloxy-6-[9-[[(1R,15S,17S)-17-ethyl-3,13-diazapentacyclo[13.3.1.02,10.04,9.013,18]nonadeca-2(10),4(9),5,7-tetraen-7-yl]oxycarbonyloxy]nonoxy]-3-methyloxan-2-yl]methyl acetate;[(2S,3R,4S,5S,6S)-4,5-diacetyloxy-6-(9-hydroxynonoxy)-3-methyloxan-2-yl]methyl acetate;(1R,15S,17S)-17-ethyl-3,13-diazapentacyclo[13.3.1.02,10.04,9.013,18]nonadeca-2(10),4(9),5,7-tetraen-7-ol;[(1R,15S,17S)-17-ethyl-3,13-diazapentacyclo[13.3.1.02,10.04,9.013,18]nonadeca-2(10),4(9),5,7-tetraen-7-yl] 9-[(2S,3S,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxynonyl carbonate;nonane-1,9-diol;tetrachlorostannane;[(2S,3R,4S,5S,6R)-4,5,6-triacetyloxy-3-methyloxan-2-yl]methyl acetate;hydroxide;hydrochloride?
The canonical SMILES for lithium;[(2S,3S,4S,5R,6R)-3-acetyloxy-2-[9-(2,5-dioxopyrrolidin-1-yl)oxycarbonyloxynonoxy]-6-ethyl-5-methyloxan-4-yl] acetate;bis(2,5-dioxopyrrolidin-1-yl) carbonate;[(2S,3R,4S,5S,6S)-4,5-diacetyloxy-6-[9-[[(1R,15S,17S)-17-ethyl-3,13-diazapentacyclo[13.3.1.02,10.04,9.013,18]nonadeca-2(10),4(9),5,7-tetraen-7-yl]oxycarbonyloxy]nonoxy]-3-methyloxan-2-yl]methyl acetate;[(2S,3R,4S,5S,6S)-4,5-diacetyloxy-6-(9-hydroxynonoxy)-3-methyloxan-2-yl]methyl acetate;(1R,15S,17S)-17-ethyl-3,13-diazapentacyclo[13.3.1.02,10.04,9.013,18]nonadeca-2(10),4(9),5,7-tetraen-7-ol;[(1R,15S,17S)-17-ethyl-3,13-diazapentacyclo[13.3.1.02,10.04,9.013,18]nonadeca-2(10),4(9),5,7-tetraen-7-yl] 9-[(2S,3S,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxynonyl carbonate;nonane-1,9-diol;tetrachlorostannane;[(2S,3R,4S,5S,6R)-4,5,6-triacetyloxy-3-methyloxan-2-yl]methyl acetate;hydroxide;hydrochloride is CC(=O)OC[C@H]1O[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H](OC(C)=O)C1C.CC(=O)OC[C@H]1O[C@H](OCCCCCCCCCO)[C@@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]1C.CC[C@H]1C[C@H]2C[C@H]3c4[nH]c5ccc(O)cc5c4CCN(C2)C13.CC[C@H]1C[C@H]2C[C@H]3c4[nH]c5ccc(OC(=O)OCCCCCCCCCO[C@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]6O)cc5c4CCN(C2)C13.CC[C@H]1C[C@H]2C[C@H]3c4[nH]c5ccc(OC(=O)OCCCCCCCCCO[C@H]6O[C@H](COC(C)=O)[C@@H](C)[C@H](OC(C)=O)[C@@H]6OC(C)=O)cc5c4CCN(C2)C13.CC[C@H]1O[C@H](OCCCCCCCCCOC(=O)ON2C(=O)CCC2=O)[C@@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]1C.Cl.Cl[Sn](Cl)(Cl)Cl.O=C(ON1C(=O)CCC1=O)ON1C(=O)CCC1=O.OCCCCCCCCCO.[Li+].[OH-].
What is the InChIKey of lithium;[(2S,3S,4S,5R,6R)-3-acetyloxy-2-[9-(2,5-dioxopyrrolidin-1-yl)oxycarbonyloxynonoxy]-6-ethyl-5-methyloxan-4-yl] acetate;bis(2,5-dioxopyrrolidin-1-yl) carbonate;[(2S,3R,4S,5S,6S)-4,5-diacetyloxy-6-[9-[[(1R,15S,17S)-17-ethyl-3,13-diazapentacyclo[13.3.1.02,10.04,9.013,18]nonadeca-2(10),4(9),5,7-tetraen-7-yl]oxycarbonyloxy]nonoxy]-3-methyloxan-2-yl]methyl acetate;[(2S,3R,4S,5S,6S)-4,5-diacetyloxy-6-(9-hydroxynonoxy)-3-methyloxan-2-yl]methyl acetate;(1R,15S,17S)-17-ethyl-3,13-diazapentacyclo[13.3.1.02,10.04,9.013,18]nonadeca-2(10),4(9),5,7-tetraen-7-ol;[(1R,15S,17S)-17-ethyl-3,13-diazapentacyclo[13.3.1.02,10.04,9.013,18]nonadeca-2(10),4(9),5,7-tetraen-7-yl] 9-[(2S,3S,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxynonyl carbonate;nonane-1,9-diol;tetrachlorostannane;[(2S,3R,4S,5S,6R)-4,5,6-triacetyloxy-3-methyloxan-2-yl]methyl acetate;hydroxide;hydrochloride?
The InChIKey is GBCMSSKSLIPLRB-QIRVWUPESA-I. The full InChI is InChI=1S/C42H60N2O11.C35H52N2O9.C26H41NO11.C22H38O9.C19H24N2O.C15H22O9.C9H8N2O7.C9H20O2.5ClH.Li.H2O.Sn/c1-6-30-20-29-21-34-37-32(16-17-44(23-29)38(30)34)33-22-31(14-15-35(33)43-37)54-42(48)50-19-13-11-9-7-8-10-12-18-49-41-40(53-28(5)47)39(52-27(4)46)25(2)36(55-41)24-51-26(3)45;1-2-22-16-21-17-26-29-24(12-13-37(19-21)30(22)26)25-18-23(10-11-27(25)36-29)45-35(42)44-15-9-7-5-3-4-6-8-14-43-34-33(41)32(40)31(39)28(20-38)46-34;1-5-20-17(2)23(35-18(3)28)24(36-19(4)29)25(37-20)33-15-11-9-7-6-8-10-12-16-34-26(32)38-27-21(30)13-14-22(27)31;1-15-19(14-28-16(2)24)31-22(21(30-18(4)26)20(15)29-17(3)25)27-13-11-9-7-5-6-8-10-12-23;1-2-12-7-11-8-16-18-14(5-6-21(10-11)19(12)16)15-9-13(22)3-4-17(15)20-18;1-7-12(6-20-8(2)16)24-15(23-11(5)19)14(22-10(4)18)13(7)21-9(3)17;12-5-1-2-6(13)10(5)17-9(16)18-11-7(14)3-4-8(11)15;10-8-6-4-2-1-3-5-7-9-11;;;;;;;;/h14-15,22,25,29-30,34,36,38-41,43H,6-13,16-21,23-24H2,1-5H3;10-11,18,21-22,26,28,30-34,36,38-41H,2-9,12-17,19-20H2,1H3;17,20,23-25H,5-16H2,1-4H3;15,19-23H,5-14H2,1-4H3;3-4,9,11-12,16,19-20,22H,2,5-8,10H2,1H3;7,12-15H,6H2,1-5H3;1-4H2;10-11H,1-9H2;5*1H;;1H2;/q;;;;;;;;;;;;;+1;;+4/p-5/t25-,29+,30+,34+,36-,38?,39+,40+,41+;21-,22-,26-,28+,30?,31+,32-,33-,34-;17-,20-,23+,24+,25+;15-,19-,20+,21+,22+;11-,12-,16-,19?;7?,12-,13+,14+,15+;;;;;;;;;;/m101101........../s1.
What are the key properties of lithium;[(2S,3S,4S,5R,6R)-3-acetyloxy-2-[9-(2,5-dioxopyrrolidin-1-yl)oxycarbonyloxynonoxy]-6-ethyl-5-methyloxan-4-yl] acetate;bis(2,5-dioxopyrrolidin-1-yl) carbonate;[(2S,3R,4S,5S,6S)-4,5-diacetyloxy-6-[9-[[(1R,15S,17S)-17-ethyl-3,13-diazapentacyclo[13.3.1.02,10.04,9.013,18]nonadeca-2(10),4(9),5,7-tetraen-7-yl]oxycarbonyloxy]nonoxy]-3-methyloxan-2-yl]methyl acetate;[(2S,3R,4S,5S,6S)-4,5-diacetyloxy-6-(9-hydroxynonoxy)-3-methyloxan-2-yl]methyl acetate;(1R,15S,17S)-17-ethyl-3,13-diazapentacyclo[13.3.1.02,10.04,9.013,18]nonadeca-2(10),4(9),5,7-tetraen-7-ol;[(1R,15S,17S)-17-ethyl-3,13-diazapentacyclo[13.3.1.02,10.04,9.013,18]nonadeca-2(10),4(9),5,7-tetraen-7-yl] 9-[(2S,3S,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxynonyl carbonate;nonane-1,9-diol;tetrachlorostannane;[(2S,3R,4S,5S,6R)-4,5,6-triacetyloxy-3-methyloxan-2-yl]methyl acetate;hydroxide;hydrochloride?
lithium;[(2S,3S,4S,5R,6R)-3-acetyloxy-2-[9-(2,5-dioxopyrrolidin-1-yl)oxycarbonyloxynonoxy]-6-ethyl-5-methyloxan-4-yl] acetate;bis(2,5-dioxopyrrolidin-1-yl) carbonate;[(2S,3R,4S,5S,6S)-4,5-diacetyloxy-6-[9-[[(1R,15S,17S)-17-ethyl-3,13-diazapentacyclo[13.3.1.02,10.04,9.013,18]nonadeca-2(10),4(9),5,7-tetraen-7-yl]oxycarbonyloxy]nonoxy]-3-methyloxan-2-yl]methyl acetate;[(2S,3R,4S,5S,6S)-4,5-diacetyloxy-6-(9-hydroxynonoxy)-3-methyloxan-2-yl]methyl acetate;(1R,15S,17S)-17-ethyl-3,13-diazapentacyclo[13.3.1.02,10.04,9.013,18]nonadeca-2(10),4(9),5,7-tetraen-7-ol;[(1R,15S,17S)-17-ethyl-3,13-diazapentacyclo[13.3.1.02,10.04,9.013,18]nonadeca-2(10),4(9),5,7-tetraen-7-yl] 9-[(2S,3S,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxynonyl carbonate;nonane-1,9-diol;tetrachlorostannane;[(2S,3R,4S,5S,6R)-4,5,6-triacetyloxy-3-methyloxan-2-yl]methyl acetate;hydroxide;hydrochloride has a molecular weight of 3784.00 g/mol, XLogP of 21.63, 76 rotatable bonds, 11 hydrogen bond donors, and 63 hydrogen bond acceptors.
Where does this data come from?
All data for lithium;[(2S,3S,4S,5R,6R)-3-acetyloxy-2-[9-(2,5-dioxopyrrolidin-1-yl)oxycarbonyloxynonoxy]-6-ethyl-5-methyloxan-4-yl] acetate;bis(2,5-dioxopyrrolidin-1-yl) carbonate;[(2S,3R,4S,5S,6S)-4,5-diacetyloxy-6-[9-[[(1R,15S,17S)-17-ethyl-3,13-diazapentacyclo[13.3.1.02,10.04,9.013,18]nonadeca-2(10),4(9),5,7-tetraen-7-yl]oxycarbonyloxy]nonoxy]-3-methyloxan-2-yl]methyl acetate;[(2S,3R,4S,5S,6S)-4,5-diacetyloxy-6-(9-hydroxynonoxy)-3-methyloxan-2-yl]methyl acetate;(1R,15S,17S)-17-ethyl-3,13-diazapentacyclo[13.3.1.02,10.04,9.013,18]nonadeca-2(10),4(9),5,7-tetraen-7-ol;[(1R,15S,17S)-17-ethyl-3,13-diazapentacyclo[13.3.1.02,10.04,9.013,18]nonadeca-2(10),4(9),5,7-tetraen-7-yl] 9-[(2S,3S,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxynonyl carbonate;nonane-1,9-diol;tetrachlorostannane;[(2S,3R,4S,5S,6R)-4,5,6-triacetyloxy-3-methyloxan-2-yl]methyl acetate;hydroxide;hydrochloride is sourced from PubChem (CID 158401848), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).