| Properties | Image |
|---|
| MNX_ID | MNXM729073 |
 |
| reference | keggC:C20730 |
| formula | C22H27N6O11P*2 |
| global charge | 0 |
| mol weight | |
| InChIKey | |
| InChI | |
| SMILES | [*]NC(=O)[C@@H](NC([*])=O)[C@@H](C)OP(=O)(O)OC[C@@H](O)[C@@H](O)[C@@H](O)CN1C2=NC(=O)NC(=O)C2=NC2=C1C=C(C)C(C)=C2 |
MNX internals
| InChI (mnx) | InChI=1/C24H33N6O11P/c1-10-6-14-15(7-11(10)2)30(21-19(27-14)23(36)29-24(37)28-21)8-16(32)20(34)17(33)9-40-42(38,39)41-12(3)18(22(35)25-5)26-13(4)31/h6-7,12,16-18,20,32-34H,8-9H2,1-5H3,(H,25,35)(H,26,31)(H,38,39)(H,29,36,37)/t12-,16+,17-,18+,20+/m1/s1/i4+1,5+1 |
 |
| SMILES (mnx) | [CH3:1][C:10]1=[CH:6][C:14]2=[C:15]([CH:7]=[C:11]1[CH3:2])[N:30]([CH2:8][C@@H:16]([C@@H:20]([C@@H:17]([CH2:9][O:40][P:42]([OH:38])(=[O:39])[O:41][C@H:12]([CH3:3])[C@@H:18]([C:22](=[N:25][13CH3:5])[OH:35])[N:26]=[C:13]([13CH3:4])[OH:31])[OH:33])[OH:34])[OH:32])[C:21]1=[N:28][C:24](=[O:37])[N:29]=[C:23]([OH:36])[C:19]1=[N:27]2 |
|