| Properties | Image |
|---|
| MNX_ID | MNXM22343 |
 |
| reference | chebi:35451 |
| formula | C15H24N2O17P2 |
| global charge | 0 |
| mol weight | 566.302 |
| InChIKey | HSCJRCZFDFQWRP-BHARQNLVSA-N |
| InChI | InChI=1S/C15H24N2O17P2/c18-3-5-8(20)10(22)12(24)14(32-5)33-36(28,29)34-35(26,27)30-4-6-9(21)11(23)13(31-6)17-2-1-7(19)16-15(17)25/h1-2,5-6,8-14,18,20-24H,3-4H2,(H,26,27)(H,28,29)(H,16,19,25)/t5-,6-,8-,9-,10+,11-,12+,13-,14?/m1/s1 |
| SMILES | O=C1C=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OC3O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]3O)[C@@H](O)[C@H]2O)C(=O)N1 |
MNX internals
| InChI (mnx) | InChI=1/C15H24N2O17P2/c18-3-5-8(20)10(22)12(24)14(32-5)33-36(28,29)34-35(26,27)30-4-6-9(21)11(23)13(31-6)17-2-1-7(19)16-15(17)25/h1-2,5-6,8-14,18,20-24H,3-4H2,(H,26,27)(H,28,29)(H,16,19,25)/t5-,6-,8-,9-,10+,11-,12+,13-,14?/m1/s1 |
 |
| SMILES (mnx) | [CH:1]1=[CH:2][N:17]([C@H:13]2[C@H:11]([OH:23])[C@H:9]([OH:21])[C@@H:6]([CH2:4][O:30][P:35]([OH:26])(=[O:27])[O:34][P:36]([OH:28])(=[O:29])[O:33][CH:14]3[C@@H:12]([OH:24])[C@@H:10]([OH:22])[C@H:8]([OH:20])[C@@H:5]([CH2:3][OH:18])[O:32]3)[O:31]2)[C:15](=[O:25])[N:16]=[C:7]1[OH:19] |
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