About lithium;(2R,3R,4R)-2-[(1R,2R)-1-[4-[2-[2-[4-[(1R,2R)-1-[(2R,3R,4S)-3-acetamido-6-carboxy-4-(diaminomethylideneamino)-3,4-dihydro-2H-pyran-2-yl]-2,3-dihydroxypropoxy]-4-oxobutoxy]ethyl-[3-[2-[2-(2-prop-2-ynoxyethoxy)ethoxy]ethoxy]propanoyl]amino]ethoxy]butanoyloxy]-2,3-dihydroxypropyl]-4-(diaminomethylideneamino)-3-methyl-3,4-dihydro-2H-pyran-6-carboxylic acid;methane;methyl (2R,3R,4R)-2-[(S)-4-[2-[2-[4-[(S)-[(2R,3R,4S)-3-acetamido-4-(diaminomethylideneamino)-6-methoxycarbonyl-3,4-dihydro-2H-pyran-2-yl]-[(4R)-2-oxo-1,3-dioxolan-4-yl]methoxy]-4-oxobutoxy]ethyl-[3-[2-[2-(2-prop-2-ynoxyethoxy)ethoxy]ethoxy]propanoyl]amino]ethoxy]butanoyloxy-[(4R)-2-oxo-1,3-dioxolan-4-yl]methyl]-4-(diaminomethylideneamino)-3-methyl-3,4-dihydro-2H-pyran-6-carboxylate;methyl (2R,3R,4R)-4-[bis[(2-methylpropan-2-yl)oxycarbonylamino]methylideneamino]-3-methyl-2-[(1S,2R)-1,2,3-triacetyloxypropyl]-3,4-dihydro-2H-pyran-6-carboxylate;hydroxide
lithium;(2R,3R,4R)-2-[(1R,2R)-1-[4-[2-[2-[4-[(1R,2R)-1-[(2R,3R,4S)-3-acetamido-6-carboxy-4-(diaminomethylideneamino)-3,4-dihydro-2H-pyran-2-yl]-2,3-dihydroxypropoxy]-4-oxobutoxy]ethyl-[3-[2-[2-(2-prop-2-ynoxyethoxy)ethoxy]ethoxy]propanoyl]amino]ethoxy]butanoyloxy]-2,3-dihydroxypropyl]-4-(diaminomethylideneamino)-3-methyl-3,4-dihydro-2H-pyran-6-carboxylic acid;methane;methyl (2R,3R,4R)-2-[(S)-4-[2-[2-[4-[(S)-[(2R,3R,4S)-3-acetamido-4-(diaminomethylideneamino)-6-methoxycarbonyl-3,4-dihydro-2H-pyran-2-yl]-[(4R)-2-oxo-1,3-dioxolan-4-yl]methoxy]-4-oxobutoxy]ethyl-[3-[2-[2-(2-prop-2-ynoxyethoxy)ethoxy]ethoxy]propanoyl]amino]ethoxy]butanoyloxy-[(4R)-2-oxo-1,3-dioxolan-4-yl]methyl]-4-(diaminomethylideneamino)-3-methyl-3,4-dihydro-2H-pyran-6-carboxylate;methyl (2R,3R,4R)-4-[bis[(2-methylpropan-2-yl)oxycarbonylamino]methylideneamino]-3-methyl-2-[(1S,2R)-1,2,3-triacetyloxypropyl]-3,4-dihydro-2H-pyran-6-carboxylate;hydroxide (PubChem CID 167638401) has the molecular formula C127H200LiN19O60
and a molecular weight of 2960.01 g/mol. Its IUPAC name is lithium;(2R,3R,4R)-2-[(1R,2R)-1-[4-[2-[2-[4-[(1R,2R)-1-[(2R,3R,4S)-3-acetamido-6-carboxy-4-(diaminomethylideneamino)-3,4-dihydro-2H-pyran-2-yl]-2,3-dihydroxypropoxy]-4-oxobutoxy]ethyl-[3-[2-[2-(2-prop-2-ynoxyethoxy)ethoxy]ethoxy]propanoyl]amino]ethoxy]butanoyloxy]-2,3-dihydroxypropyl]-4-(diaminomethylideneamino)-3-methyl-3,4-dihydro-2H-pyran-6-carboxylic acid;methane;methyl (2R,3R,4R)-2-[(S)-4-[2-[2-[4-[(S)-[(2R,3R,4S)-3-acetamido-4-(diaminomethylideneamino)-6-methoxycarbonyl-3,4-dihydro-2H-pyran-2-yl]-[(4R)-2-oxo-1,3-dioxolan-4-yl]methoxy]-4-oxobutoxy]ethyl-[3-[2-[2-(2-prop-2-ynoxyethoxy)ethoxy]ethoxy]propanoyl]amino]ethoxy]butanoyloxy-[(4R)-2-oxo-1,3-dioxolan-4-yl]methyl]-4-(diaminomethylideneamino)-3-methyl-3,4-dihydro-2H-pyran-6-carboxylate;methyl (2R,3R,4R)-4-[bis[(2-methylpropan-2-yl)oxycarbonylamino]methylideneamino]-3-methyl-2-[(1S,2R)-1,2,3-triacetyloxypropyl]-3,4-dihydro-2H-pyran-6-carboxylate;hydroxide.
Frequently Asked Questions
What is the IUPAC name of lithium;(2R,3R,4R)-2-[(1R,2R)-1-[4-[2-[2-[4-[(1R,2R)-1-[(2R,3R,4S)-3-acetamido-6-carboxy-4-(diaminomethylideneamino)-3,4-dihydro-2H-pyran-2-yl]-2,3-dihydroxypropoxy]-4-oxobutoxy]ethyl-[3-[2-[2-(2-prop-2-ynoxyethoxy)ethoxy]ethoxy]propanoyl]amino]ethoxy]butanoyloxy]-2,3-dihydroxypropyl]-4-(diaminomethylideneamino)-3-methyl-3,4-dihydro-2H-pyran-6-carboxylic acid;methane;methyl (2R,3R,4R)-2-[(S)-4-[2-[2-[4-[(S)-[(2R,3R,4S)-3-acetamido-4-(diaminomethylideneamino)-6-methoxycarbonyl-3,4-dihydro-2H-pyran-2-yl]-[(4R)-2-oxo-1,3-dioxolan-4-yl]methoxy]-4-oxobutoxy]ethyl-[3-[2-[2-(2-prop-2-ynoxyethoxy)ethoxy]ethoxy]propanoyl]amino]ethoxy]butanoyloxy-[(4R)-2-oxo-1,3-dioxolan-4-yl]methyl]-4-(diaminomethylideneamino)-3-methyl-3,4-dihydro-2H-pyran-6-carboxylate;methyl (2R,3R,4R)-4-[bis[(2-methylpropan-2-yl)oxycarbonylamino]methylideneamino]-3-methyl-2-[(1S,2R)-1,2,3-triacetyloxypropyl]-3,4-dihydro-2H-pyran-6-carboxylate;hydroxide?
The IUPAC name of lithium;(2R,3R,4R)-2-[(1R,2R)-1-[4-[2-[2-[4-[(1R,2R)-1-[(2R,3R,4S)-3-acetamido-6-carboxy-4-(diaminomethylideneamino)-3,4-dihydro-2H-pyran-2-yl]-2,3-dihydroxypropoxy]-4-oxobutoxy]ethyl-[3-[2-[2-(2-prop-2-ynoxyethoxy)ethoxy]ethoxy]propanoyl]amino]ethoxy]butanoyloxy]-2,3-dihydroxypropyl]-4-(diaminomethylideneamino)-3-methyl-3,4-dihydro-2H-pyran-6-carboxylic acid;methane;methyl (2R,3R,4R)-2-[(S)-4-[2-[2-[4-[(S)-[(2R,3R,4S)-3-acetamido-4-(diaminomethylideneamino)-6-methoxycarbonyl-3,4-dihydro-2H-pyran-2-yl]-[(4R)-2-oxo-1,3-dioxolan-4-yl]methoxy]-4-oxobutoxy]ethyl-[3-[2-[2-(2-prop-2-ynoxyethoxy)ethoxy]ethoxy]propanoyl]amino]ethoxy]butanoyloxy-[(4R)-2-oxo-1,3-dioxolan-4-yl]methyl]-4-(diaminomethylideneamino)-3-methyl-3,4-dihydro-2H-pyran-6-carboxylate;methyl (2R,3R,4R)-4-[bis[(2-methylpropan-2-yl)oxycarbonylamino]methylideneamino]-3-methyl-2-[(1S,2R)-1,2,3-triacetyloxypropyl]-3,4-dihydro-2H-pyran-6-carboxylate;hydroxide (CID 167638401) is lithium;(2R,3R,4R)-2-[(1R,2R)-1-[4-[2-[2-[4-[(1R,2R)-1-[(2R,3R,4S)-3-acetamido-6-carboxy-4-(diaminomethylideneamino)-3,4-dihydro-2H-pyran-2-yl]-2,3-dihydroxypropoxy]-4-oxobutoxy]ethyl-[3-[2-[2-(2-prop-2-ynoxyethoxy)ethoxy]ethoxy]propanoyl]amino]ethoxy]butanoyloxy]-2,3-dihydroxypropyl]-4-(diaminomethylideneamino)-3-methyl-3,4-dihydro-2H-pyran-6-carboxylic acid;methane;methyl (2R,3R,4R)-2-[(S)-4-[2-[2-[4-[(S)-[(2R,3R,4S)-3-acetamido-4-(diaminomethylideneamino)-6-methoxycarbonyl-3,4-dihydro-2H-pyran-2-yl]-[(4R)-2-oxo-1,3-dioxolan-4-yl]methoxy]-4-oxobutoxy]ethyl-[3-[2-[2-(2-prop-2-ynoxyethoxy)ethoxy]ethoxy]propanoyl]amino]ethoxy]butanoyloxy-[(4R)-2-oxo-1,3-dioxolan-4-yl]methyl]-4-(diaminomethylideneamino)-3-methyl-3,4-dihydro-2H-pyran-6-carboxylate;methyl (2R,3R,4R)-4-[bis[(2-methylpropan-2-yl)oxycarbonylamino]methylideneamino]-3-methyl-2-[(1S,2R)-1,2,3-triacetyloxypropyl]-3,4-dihydro-2H-pyran-6-carboxylate;hydroxide.
What is the SMILES notation for lithium;(2R,3R,4R)-2-[(1R,2R)-1-[4-[2-[2-[4-[(1R,2R)-1-[(2R,3R,4S)-3-acetamido-6-carboxy-4-(diaminomethylideneamino)-3,4-dihydro-2H-pyran-2-yl]-2,3-dihydroxypropoxy]-4-oxobutoxy]ethyl-[3-[2-[2-(2-prop-2-ynoxyethoxy)ethoxy]ethoxy]propanoyl]amino]ethoxy]butanoyloxy]-2,3-dihydroxypropyl]-4-(diaminomethylideneamino)-3-methyl-3,4-dihydro-2H-pyran-6-carboxylic acid;methane;methyl (2R,3R,4R)-2-[(S)-4-[2-[2-[4-[(S)-[(2R,3R,4S)-3-acetamido-4-(diaminomethylideneamino)-6-methoxycarbonyl-3,4-dihydro-2H-pyran-2-yl]-[(4R)-2-oxo-1,3-dioxolan-4-yl]methoxy]-4-oxobutoxy]ethyl-[3-[2-[2-(2-prop-2-ynoxyethoxy)ethoxy]ethoxy]propanoyl]amino]ethoxy]butanoyloxy-[(4R)-2-oxo-1,3-dioxolan-4-yl]methyl]-4-(diaminomethylideneamino)-3-methyl-3,4-dihydro-2H-pyran-6-carboxylate;methyl (2R,3R,4R)-4-[bis[(2-methylpropan-2-yl)oxycarbonylamino]methylideneamino]-3-methyl-2-[(1S,2R)-1,2,3-triacetyloxypropyl]-3,4-dihydro-2H-pyran-6-carboxylate;hydroxide?
The canonical SMILES for lithium;(2R,3R,4R)-2-[(1R,2R)-1-[4-[2-[2-[4-[(1R,2R)-1-[(2R,3R,4S)-3-acetamido-6-carboxy-4-(diaminomethylideneamino)-3,4-dihydro-2H-pyran-2-yl]-2,3-dihydroxypropoxy]-4-oxobutoxy]ethyl-[3-[2-[2-(2-prop-2-ynoxyethoxy)ethoxy]ethoxy]propanoyl]amino]ethoxy]butanoyloxy]-2,3-dihydroxypropyl]-4-(diaminomethylideneamino)-3-methyl-3,4-dihydro-2H-pyran-6-carboxylic acid;methane;methyl (2R,3R,4R)-2-[(S)-4-[2-[2-[4-[(S)-[(2R,3R,4S)-3-acetamido-4-(diaminomethylideneamino)-6-methoxycarbonyl-3,4-dihydro-2H-pyran-2-yl]-[(4R)-2-oxo-1,3-dioxolan-4-yl]methoxy]-4-oxobutoxy]ethyl-[3-[2-[2-(2-prop-2-ynoxyethoxy)ethoxy]ethoxy]propanoyl]amino]ethoxy]butanoyloxy-[(4R)-2-oxo-1,3-dioxolan-4-yl]methyl]-4-(diaminomethylideneamino)-3-methyl-3,4-dihydro-2H-pyran-6-carboxylate;methyl (2R,3R,4R)-4-[bis[(2-methylpropan-2-yl)oxycarbonylamino]methylideneamino]-3-methyl-2-[(1S,2R)-1,2,3-triacetyloxypropyl]-3,4-dihydro-2H-pyran-6-carboxylate;hydroxide is C.C#CCOCCOCCOCCOCCC(=O)N(CCOCCCC(=O)O[C@@H]([C@@H]1OC(C(=O)O)=C[C@H](N=C(N)N)[C@H]1C)[C@H](O)CO)CCOCCCC(=O)O[C@@H]([C@@H]1OC(C(=O)O)=C[C@H](N=C(N)N)[C@H]1NC(C)=O)[C@H](O)CO.C#CCOCCOCCOCCOCCC(=O)N(CCOCCCC(=O)O[C@@H]([C@@H]1OC(C(=O)OC)=C[C@H](N=C(N)N)[C@H]1C)[C@H]1COC(=O)O1)CCOCCCC(=O)O[C@@H]([C@@H]1OC(C(=O)OC)=C[C@H](N=C(N)N)[C@H]1NC(C)=O)[C@H]1COC(=O)O1.COC(=O)C1=C[C@H](N=C(NC(=O)OC(C)(C)C)NC(=O)OC(C)(C)C)[C@@H](C)[C@H]([C@H](OC(C)=O)[C@@H](COC(C)=O)OC(C)=O)O1.[Li+].[OH-].
What is the InChIKey of lithium;(2R,3R,4R)-2-[(1R,2R)-1-[4-[2-[2-[4-[(1R,2R)-1-[(2R,3R,4S)-3-acetamido-6-carboxy-4-(diaminomethylideneamino)-3,4-dihydro-2H-pyran-2-yl]-2,3-dihydroxypropoxy]-4-oxobutoxy]ethyl-[3-[2-[2-(2-prop-2-ynoxyethoxy)ethoxy]ethoxy]propanoyl]amino]ethoxy]butanoyloxy]-2,3-dihydroxypropyl]-4-(diaminomethylideneamino)-3-methyl-3,4-dihydro-2H-pyran-6-carboxylic acid;methane;methyl (2R,3R,4R)-2-[(S)-4-[2-[2-[4-[(S)-[(2R,3R,4S)-3-acetamido-4-(diaminomethylideneamino)-6-methoxycarbonyl-3,4-dihydro-2H-pyran-2-yl]-[(4R)-2-oxo-1,3-dioxolan-4-yl]methoxy]-4-oxobutoxy]ethyl-[3-[2-[2-(2-prop-2-ynoxyethoxy)ethoxy]ethoxy]propanoyl]amino]ethoxy]butanoyloxy-[(4R)-2-oxo-1,3-dioxolan-4-yl]methyl]-4-(diaminomethylideneamino)-3-methyl-3,4-dihydro-2H-pyran-6-carboxylate;methyl (2R,3R,4R)-4-[bis[(2-methylpropan-2-yl)oxycarbonylamino]methylideneamino]-3-methyl-2-[(1S,2R)-1,2,3-triacetyloxypropyl]-3,4-dihydro-2H-pyran-6-carboxylate;hydroxide?
The InChIKey is OUQDSNCSRINZFW-WGDQRFFVSA-M. The full InChI is InChI=1S/C51H76N8O24.C47H76N8O22.C28H43N3O13.CH4.Li.H2O/c1-6-14-70-20-22-74-24-25-75-23-21-73-17-11-38(61)59(12-18-71-15-7-9-39(62)82-43(36-28-76-50(66)80-36)42-30(2)32(57-48(52)53)26-34(78-42)46(64)68-4)13-19-72-16-8-10-40(63)83-44(37-29-77-51(67)81-37)45-41(56-31(3)60)33(58-49(54)55)27-35(79-45)47(65)69-5;1-4-12-68-18-20-72-22-23-73-21-19-71-15-9-36(61)55(10-16-69-13-5-7-37(62)76-41(32(59)26-56)40-28(2)30(53-46(48)49)24-34(74-40)44(64)65)11-17-70-14-6-8-38(63)77-42(33(60)27-57)43-39(52-29(3)58)31(54-47(50)51)25-35(75-43)45(66)67;1-14-18(29-24(30-25(36)43-27(5,6)7)31-26(37)44-28(8,9)10)12-19(23(35)38-11)42-21(14)22(41-17(4)34)20(40-16(3)33)13-39-15(2)32;;;/h1,26-27,30,32-33,36-37,41-45H,7-25,28-29H2,2-5H3,(H,56,60)(H4,52,53,57)(H4,54,55,58);1,24-25,28,30-33,39-43,56-57,59-60H,5-23,26-27H2,2-3H3,(H,52,58)(H,64,65)(H,66,67)(H4,48,49,53)(H4,50,51,54);12,14,18,20-22H,13H2,1-11H3,(H2,29,30,31,36,37);1H4;;1H2/q;;;;+1;/p-1/t30-,32+,33+,36-,37-,41-,42-,43-,44-,45-;28-,30+,31+,32-,33-,39-,40-,41-,42-,43-;14-,18+,20-,21-,22-;;;/m111.../s1.
What are the key properties of lithium;(2R,3R,4R)-2-[(1R,2R)-1-[4-[2-[2-[4-[(1R,2R)-1-[(2R,3R,4S)-3-acetamido-6-carboxy-4-(diaminomethylideneamino)-3,4-dihydro-2H-pyran-2-yl]-2,3-dihydroxypropoxy]-4-oxobutoxy]ethyl-[3-[2-[2-(2-prop-2-ynoxyethoxy)ethoxy]ethoxy]propanoyl]amino]ethoxy]butanoyloxy]-2,3-dihydroxypropyl]-4-(diaminomethylideneamino)-3-methyl-3,4-dihydro-2H-pyran-6-carboxylic acid;methane;methyl (2R,3R,4R)-2-[(S)-4-[2-[2-[4-[(S)-[(2R,3R,4S)-3-acetamido-4-(diaminomethylideneamino)-6-methoxycarbonyl-3,4-dihydro-2H-pyran-2-yl]-[(4R)-2-oxo-1,3-dioxolan-4-yl]methoxy]-4-oxobutoxy]ethyl-[3-[2-[2-(2-prop-2-ynoxyethoxy)ethoxy]ethoxy]propanoyl]amino]ethoxy]butanoyloxy-[(4R)-2-oxo-1,3-dioxolan-4-yl]methyl]-4-(diaminomethylideneamino)-3-methyl-3,4-dihydro-2H-pyran-6-carboxylate;methyl (2R,3R,4R)-4-[bis[(2-methylpropan-2-yl)oxycarbonylamino]methylideneamino]-3-methyl-2-[(1S,2R)-1,2,3-triacetyloxypropyl]-3,4-dihydro-2H-pyran-6-carboxylate;hydroxide?
lithium;(2R,3R,4R)-2-[(1R,2R)-1-[4-[2-[2-[4-[(1R,2R)-1-[(2R,3R,4S)-3-acetamido-6-carboxy-4-(diaminomethylideneamino)-3,4-dihydro-2H-pyran-2-yl]-2,3-dihydroxypropoxy]-4-oxobutoxy]ethyl-[3-[2-[2-(2-prop-2-ynoxyethoxy)ethoxy]ethoxy]propanoyl]amino]ethoxy]butanoyloxy]-2,3-dihydroxypropyl]-4-(diaminomethylideneamino)-3-methyl-3,4-dihydro-2H-pyran-6-carboxylic acid;methane;methyl (2R,3R,4R)-2-[(S)-4-[2-[2-[4-[(S)-[(2R,3R,4S)-3-acetamido-4-(diaminomethylideneamino)-6-methoxycarbonyl-3,4-dihydro-2H-pyran-2-yl]-[(4R)-2-oxo-1,3-dioxolan-4-yl]methoxy]-4-oxobutoxy]ethyl-[3-[2-[2-(2-prop-2-ynoxyethoxy)ethoxy]ethoxy]propanoyl]amino]ethoxy]butanoyloxy-[(4R)-2-oxo-1,3-dioxolan-4-yl]methyl]-4-(diaminomethylideneamino)-3-methyl-3,4-dihydro-2H-pyran-6-carboxylate;methyl (2R,3R,4R)-4-[bis[(2-methylpropan-2-yl)oxycarbonylamino]methylideneamino]-3-methyl-2-[(1S,2R)-1,2,3-triacetyloxypropyl]-3,4-dihydro-2H-pyran-6-carboxylate;hydroxide has a molecular weight of 2960.01 g/mol, XLogP of -7.34, 86 rotatable bonds, 18 hydrogen bond donors, and 63 hydrogen bond acceptors.
Where does this data come from?
All data for lithium;(2R,3R,4R)-2-[(1R,2R)-1-[4-[2-[2-[4-[(1R,2R)-1-[(2R,3R,4S)-3-acetamido-6-carboxy-4-(diaminomethylideneamino)-3,4-dihydro-2H-pyran-2-yl]-2,3-dihydroxypropoxy]-4-oxobutoxy]ethyl-[3-[2-[2-(2-prop-2-ynoxyethoxy)ethoxy]ethoxy]propanoyl]amino]ethoxy]butanoyloxy]-2,3-dihydroxypropyl]-4-(diaminomethylideneamino)-3-methyl-3,4-dihydro-2H-pyran-6-carboxylic acid;methane;methyl (2R,3R,4R)-2-[(S)-4-[2-[2-[4-[(S)-[(2R,3R,4S)-3-acetamido-4-(diaminomethylideneamino)-6-methoxycarbonyl-3,4-dihydro-2H-pyran-2-yl]-[(4R)-2-oxo-1,3-dioxolan-4-yl]methoxy]-4-oxobutoxy]ethyl-[3-[2-[2-(2-prop-2-ynoxyethoxy)ethoxy]ethoxy]propanoyl]amino]ethoxy]butanoyloxy-[(4R)-2-oxo-1,3-dioxolan-4-yl]methyl]-4-(diaminomethylideneamino)-3-methyl-3,4-dihydro-2H-pyran-6-carboxylate;methyl (2R,3R,4R)-4-[bis[(2-methylpropan-2-yl)oxycarbonylamino]methylideneamino]-3-methyl-2-[(1S,2R)-1,2,3-triacetyloxypropyl]-3,4-dihydro-2H-pyran-6-carboxylate;hydroxide is sourced from PubChem (CID 167638401), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).