| Properties | Image |
|---|
| MNX_ID | MNXM146908 |
 |
| reference | chebi:78556 |
| formula | C22H32N8O8P* |
| global charge | 0 |
| mol weight | |
| InChIKey | |
| InChI | |
| SMILES | [*]P(=O)([O-])OC[C@H]1O[C@@H](N2C=NC3=C2N=CN=C3N)[C@H](O)[C@@H]1OC(=O)[C@@H]([NH3+])CCCCNC(=O)[C@@H]1N=CC[C@H]1C |
MNX internals
| InChI (mnx) | InChI=1/C23H35N8O8P/c1-12-6-8-26-15(12)21(33)27-7-4-3-5-13(24)23(34)39-18-14(9-37-40(2,35)36)38-22(17(18)32)31-11-30-16-19(25)28-10-29-20(16)31/h8,10-15,17-18,22,32H,3-7,9,24H2,1-2H3,(H,27,33)(H,35,36)(H2,25,28,29)/t12-,13+,14-,15-,17-,18-,22-/m1/s1/i2+1 |
 |
| SMILES (mnx) | [CH3:1][C@@H:12]1[CH2:6][CH:8]=[N:26][C@H:15]1[C:21](=[N:27][CH2:7][CH2:4][CH2:3][CH2:5][C@@H:13]([C:23](=[O:34])[O:39][C@@H:18]1[C@@H:14]([CH2:9][O:37][P:40]([13CH3:2])([OH:35])=[O:36])[O:38][C@@H:22]([N:31]2[CH:11]=[N:30][C:16]3=[C:19]([NH2:25])[N:28]=[CH:10][N:29]=[C:20]32)[C@@H:17]1[OH:32])[NH2:24])[OH:33] |
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