| Properties | Image |
| MNX_ID | MNXM62335 |
 |
| reference | chebi:52995 |
| formula | C10H14N5O7PS |
| global charge | 0 |
| mol weight | 379.291 |
| InChIKey | LKOHPNNPOQMIGG-UHFFFAOYSA-N |
| InChI | InChI=1S/C10H14N5O7PS/c11-10-14-7-4(8(17)15-10)12-3-6(24)5(16)2(22-9(3)13-7)1-21-23(18,19)20/h2-3,9,12,16,24H,1H2,(H2,18,19,20)(H4,11,13,14,15,17) |
| SMILES | NC1=NC2=C(NC3C(S)=C(O)C(COP(=O)(O)O)OC3N2)C(=O)N1 |
MNX internals
| InChI (mnx) | InChI=1/C10H14N5O7PS/c11-10-14-7-4(8(17)15-10)12-3-6(24)5(16)2(22-9(3)13-7)1-21-23(18,19)20/h2-3,9,12,16,24H,1H2,(H2,18,19,20)(H4,11,13,14,15,17)/t2?,3?,9? |
 |
| SMILES (mnx) | [CH2:1]([CH:2]1[C:5]([OH:16])=[C:6]([SH:24])[CH:3]2[CH:9]([NH:13][C:7]3=[C:4]([C:8]([OH:17])=[N:15][C:10](=[NH:11])[NH:14]3)[NH:12]2)[O:22]1)[O:21][P:23]([OH:18])([OH:19])=[O:20] |
|