| Properties | Image |
| MNX_ID | MNXM164747 |
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| reference | chebi:192479 |
| formula | C16H27N3O15P2 |
| global charge | 0 |
| mol weight | 563.346 |
| InChIKey | CTQMTTSIKPKZPI-LPGAPTBISA-N |
| InChI | InChI=1S/C16H27N3O15P2/c1-6-4-19(16(24)17-14(6)23)10-3-8(20)9(32-10)5-30-35(26,27)34-36(28,29)33-15-13(22)12(21)11(18-25)7(2)31-15/h4,7-13,15,18,20-22,25H,3,5H2,1-2H3,(H,26,27)(H,28,29)(H,17,23,24)/t7-,8+,9-,10-,11-,12+,13-,15-/m1/s1 |
| SMILES | Cc1cn([C@H]2C[C@H](O)[C@@H](COP(=O)(O)OP(=O)(O)O[C@H]3O[C@H](C)[C@@H](NO)[C@H](O)[C@H]3O)O2)c(=O)[nH]c1=O |
MNX internals
| InChI (mnx) | InChI=1/C16H27N3O15P2/c1-6-4-19(16(24)17-14(6)23)10-3-8(20)9(32-10)5-30-35(26,27)34-36(28,29)33-15-13(22)12(21)11(18-25)7(2)31-15/h4,7-13,15,18,20-22,25H,3,5H2,1-2H3,(H,26,27)(H,28,29)(H,17,23,24)/t7-,8+,9-,10-,11-,12+,13-,15-/m1/s1 |
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| SMILES (mnx) | [C:1]([CH2:5][O:29]1[CH2:4][O@:25]([OH:31])[O@@:21]([NH:19][CH3:11])[O@:22]([CH3:6])[O@:26]1[CH3:8])([CH2:10][C:2]([CH2:9][O:30][O@:24]1[CH2:3][O@:28]([N:18]2[O:32]=[O:34]([PH2:36])[PH:35](=[NH:17])[O:20][O:33]2=[CH2:13])[O:27][O@@:23]1[CH3:7])([CH3:15])=[CH2:16])([CH3:12])=[CH2:14] |
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