Glycoside
GD038259
Name:
[(2~{s},3~{r},4~{r})-5-[8-methanoyl-7-methyl-2,4-bis(oxidanylidene)-1~{h}-benzo[g]pteridin-10-ium-10-yl]-2,3,4-tris(oxidanyl)pentyl] dihydrogen phosphateFormula:
C17H20O10N4PSmiles:
Cc1cc2nc3c(=O)[nH]c(=O)[nH]c3[n+](C[C@@H](O)[C@@H](O)[C@@H](O)COP(=O)(O)O)c2cc1C=OAglycone:
Cc1cc2nc3c(=O)[nH]c(=O)[nH]c3[n+](C)c2cc1C=OSugarmoiety:
O=P(O)(O)OCC(O)C(O)C(O)OOther Identifiers
Properties
| HBA: | 14 | RingCount: | 3 |
| HBD: | 7 | FractionCSP3: | 0.35 |
| AlogP: | -2.63 | Num_rotatable_bonds: | 8 |
| MolWt: | 471.34 | Num_heavy_atoms: | 32 |
| TPSA: | 227.01 | NumAromaticRings: | 3 |
Unique Aglycone
AD23935
Formula: C13H11O3N4
Smiles:
Cc1cc2nc3c(=O)[nH]c(=O)[nH]c3[n+](C)c2cc1C=O| HBA: | 7 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.15 |
| AlogP: | -0.29 | Num_rotatable_bonds: | 1 |
| MolWt: | 271.26 | Num_heavy_atoms: | 20 |
| TPSA: | 99.56 | NumAromaticRings: | 3 |
