EMBL-EBI | Chemical Biology | ChEBI
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| Formula | (C29H38N7O20P3)n.(C30H38N15O16P3)n.H4O2 |
| Net Charge | 0 |
| Average Mass | 1891.249 |
| Monoisotopic Mass | 1890.34296 |
| SMILES | [H]O[C@H]1C[C@H](n2ccc(N)nc2=O)O[C@@H]1COP(=O)(O)O[C@H]1C[C@H](n2cc(C)c(=O)nc2=O)O[C@@H]1COP(=O)(O)O[C@H]1C[C@H](n2cc(C)c(=O)nc2=O)O[C@@H]1COP(=O)(O)O.[H]O[C@H]1C[C@H](n2cnc3c(N)ncnc32)O[C@@H]1COP(=O)(O)O[C@H]1C[C@H](N2C=NC3=C(N)N=CNC32)O[C@@H]1COP(=O)(O)O[C@H]1C[C@H](n2cnc3c(=O)nc(N)nc32)O[C@@H]1COP(=O)(O)O |
| InChI | InChI=1S/C30H40N15O17P3.C29H40N7O21P3/c31-24-21-26(36-7-34-24)43(9-38-21)18-1-12(46)15(58-18)4-56-64(51,52)62-14-2-19(44-10-39-22-25(32)35-8-37-27(22)44)60-17(14)6-57-65(53,54)61-13-3-20(59-16(13)5-55-63(48,49)50)45-11-40-23-28(45)41-30(33)42-29(23)47;1-13-8-35(28(41)32-25(13)38)23-6-16(19(54-23)11-50-58(43,44)45)56-60(48,49)52-12-20-17(7-24(55-20)36-9-14(2)26(39)33-29(36)42)57-59(46,47)51-10-18-15(37)5-22(53-18)34-4-3-21(30)31-27(34)40/h7-20,27,46H,1-6,32H2,(H,35,37)(H,51,52)(H,53,54)(H2,31,34,36)(H2,48,49,50)(H3,33,41,42,47);3-4,8-9,15-20,22-24,37H,5-7,10-12H2,1-2H3,(H,46,47)(H,48,49)(H2,30,31,40)(H,32,38,41)(H,33,39,42)(H2,43,44,45)/t12-,13-,14-,15+,16+,17+,18+,19+,20+,27?;15-,16-,17-,18+,19+,20+,22+,23+,24+/m00/s1 |
| InChIKey | XAQWXWKKOUUKAB-YDBNMWCWSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| poly[d(TTC)]·poly[d(GAA)] (CHEBI:76019) has part poly[d(GAA)] (CHEBI:76021) |
| poly[d(TTC)]·poly[d(GAA)] (CHEBI:76019) has part poly[d(TTC)] (CHEBI:76020) |
| poly[d(TTC)]·poly[d(GAA)] (CHEBI:76019) is a double-stranded DNA polynucleotide (CHEBI:75979) |
| Citations |
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