| Properties | Image |
|---|
| MNX_ID | MNXM1108117 |
 |
| reference | seedM:cpd02079 |
| formula | C15H20N5O17P3 |
| global charge | -4 |
| mol weight | 635.265 |
| InChIKey | ICNHOLCERMYLRZ-TYASJMOZSA-J |
| InChI | InChI=1S/C15H24N5O17P3/c16-12-7-13(18-3-17-12)20(4-19-7)14-11(36-38(25,26)27)9(22)6(34-14)2-33-40(30,31)37-39(28,29)32-1-5-8(21)10(23)15(24)35-5/h3-6,8-11,14-15,21-24H,1-2H2,(H,28,29)(H,30,31)(H2,16,17,18)(H2,25,26,27)/p-4/t5-,6-,8-,9-,10-,11-,14-,15?/m1/s1 |
| SMILES | NC1=NC=NC2=C1N=CN2[C@@H]1O[C@H](COP(=O)([O-])OP(=O)([O-])OC[C@H]2OC(O)[C@H](O)[C@@H]2O)[C@@H](O)[C@H]1OP(=O)([O-])[O-] |
MNX internals
| InChI (mnx) | InChI=1/C15H24N5O17P3/c16-12-7-13(18-3-17-12)20(4-19-7)14-11(36-38(25,26)27)9(22)6(34-14)2-33-40(30,31)37-39(28,29)32-1-5-8(21)10(23)15(24)35-5/h3-6,8-11,14-15,21-24H,1-2H2,(H,28,29)(H,30,31)(H2,16,17,18)(H2,25,26,27)/t5-,6-,8-,9-,10-,11-,14-,15?/m1/s1 |
 |
| SMILES (mnx) | [CH2:1]([C@@H:5]1[C@@H:8]([OH:21])[C@@H:10]([OH:23])[CH:15]([OH:24])[O:35]1)[O:32][P:39]([OH:28])(=[O:29])[O:37][P:40]([OH:30])(=[O:31])[O:33][CH2:2][C@@H:6]1[C@@H:9]([OH:22])[C@@H:11]([O:36][P:38]([OH:25])([OH:26])=[O:27])[C@H:14]([N:20]2[CH:4]=[N:19][C:7]3=[C:12]([NH2:16])[N:17]=[CH:3][N:18]=[C:13]32)[O:34]1 |
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