| Properties | Image | Occurences in reactions |
|---|
| MNX_ID | MNXM1523965 | 
|
| #reac |
|---|
| in my sandbox |
0 |
| in MNXref (generic) | 2 |
| in models (compartimentalized) |
0 |
|
| formula | C18H30N3O14P2 |
| charge | -1 |
| mass | 574.391 |
| reference | metacycM:CPD-25724 |
| InChIKey | WQJWKRKVFWTDQA-UHFFFAOYSA-M |
| InChI | InChI=1S/C18H31N3O14P2/c1-8-6-21(17(25)20-15(8)24)12-5-10(22)11(33-12)7-31-36(27,28)35-37(29,30)34-16-14(23)18(3,26)13(19-4)9(2)32-16/h6,9-14,16,19,22-23,26H,5,7H2,1-4H3,(H,27,28)(H,29,30)(H,20,24,25)/p-1 |
| SMILES | [CH3:1][c:8]1[cH:6][n:21]([CH:12]2[CH2:5][CH:10]([OH:22])[CH:11]([CH2:7][O:31][P:36]([OH:27])(=[O:28])[O:35][P:37]([OH:29])(=[O:30])[O:34][CH:16]3[CH:14]([OH:23])[C:18]([CH3:3])([OH:26])[CH:13]([NH:19][CH3:4])[CH:9]([CH3:2])[O:32]3)[O:33]2)[c:17](=[O:25])[n:20][c:15]1[OH:24] |
|
