| Properties | Image |
|---|
| MNX_ID | MNXM729421 |
 |
| reference | biggM:prbamp |
| formula | C15H22N5O14P2 |
| global charge | -1 |
| mol weight | 558.31 |
| InChIKey | PJTKTOMRVMPIEN-UHFFFAOYSA-M |
| InChI | InChI=1S/C15H23N5O14P2/c16-12-7-13(18-4-19(12)14-10(23)8(21)5(33-14)1-31-35(25,26)27)20(3-17-7)15-11(24)9(22)6(34-15)2-32-36(28,29)30/h3-6,8-11,14-16,21-24H,1-2H2,(H4,25,26,27,28,29,30)/p-1 |
| SMILES | NC1=[N+](C2OC(COP(=O)([O-])O)C(O)C2O)C=NC2=C1N=CN2C1OC(COP(=O)([O-])O)C(O)C1O |
MNX internals
| InChI (mnx) | InChI=1/C15H23N5O14P2/c16-12-7-13(18-4-19(12)14-10(23)8(21)5(33-14)1-31-35(25,26)27)20(3-17-7)15-11(24)9(22)6(34-15)2-32-36(28,29)30/h3-6,8-11,14-16,21-24H,1-2H2,(H4,25,26,27,28,29,30)/t5?,6?,8?,9?,10?,11?,14?,15? |
 |
| SMILES (mnx) | [CH2:1]([CH:5]1[CH:8]([OH:21])[CH:10]([OH:23])[CH:14]([N+:19]2=[C:12]([NH2:16])[C:7]3=[C:13]([N:18]=[CH:4]2)[N:20]([CH:15]2[CH:11]([OH:24])[CH:9]([OH:22])[CH:6]([CH2:2][O:32][P:36]([OH:28])(=[O:29])[OH:30])[O:34]2)[CH:3]=[N:17]3)[O:33]1)[O:31][P:35](=[O:25])([O-:26])[OH:27] |
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