| Properties | Image | Occurences in reactions |
|---|
| MNX_ID | MNXM1364264 | 
|
| #reac |
|---|
| in my sandbox |
0 |
| in MNXref (generic) | 2 |
| in models (compartimentalized) |
0 |
|
| formula | C16H22N2O14P2 |
| charge | -2 |
| mass | 528.298 |
| reference | metacycM:CPD-13777 |
| InChIKey | RZMOCWAVIGQAOB-UHFFFAOYSA-L |
| InChI | InChI=1S/C16H24N2O14P2/c1-7-5-18(16(23)17-14(7)22)12-4-9(19)11(30-12)6-28-33(24,25)32-34(26,27)31-15-13(21)10(20)3-8(2)29-15/h5,8-9,11-13,15,19,21H,3-4,6H2,1-2H3,(H,24,25)(H,26,27)(H,17,22,23)/p-2 |
| SMILES | [CH3:1][c:7]1[cH:5][n:18]([CH:12]2[CH2:4][CH:9]([OH:19])[CH:11]([CH2:6][O:28][P:33]([OH:24])(=[O:25])[O:32][P:34]([OH:26])(=[O:27])[O:31][CH:15]3[CH:13]([OH:21])[C:10](=[O:20])[CH2:3][CH:8]([CH3:2])[O:29]3)[O:30]2)[c:16](=[O:23])[n:17][c:14]1[OH:22] |
|
