Glycoside
GD117481
Name:
FosfocytocinFormula:
C12H20O13N4P2Smiles:
N=c1ccn(C2OC(COP(=O)(O)OP(=O)(O)OCCN(O)C=O)C(O)C2O)c(O)n1Aglycone:
COP(=O)(O)OP(=O)(O)OCCN(O)C=O.N=C1C=C[N]C(O)=N1Sugarmoiety:
OC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 17 | RingCount: | 2 |
| HBD: | 7 | FractionCSP3: | 0.58 |
| AlogP: | -2.21 | Num_rotatable_bonds: | 11 |
| MolWt: | 490.26 | Num_heavy_atoms: | 31 |
| TPSA: | 254.42 | NumAromaticRings: | 1 |
Unique Aglycone
AD45484
Formula: C4H4ON3
Smiles:
N=C1C=C[N]C(O)=N1| HBA: | 4 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | 0.01 | Num_rotatable_bonds: | 0 |
| MolWt: | 110.1 | Num_heavy_atoms: | 8 |
| TPSA: | 70.54 | NumAromaticRings: | 0 |
AD46845
Formula: C4H11O9NP2
Smiles:
COP(=O)(O)OP(=O)(O)OCCN(O)C=O| HBA: | 10 | RingCount: | 0 |
| HBD: | 3 | FractionCSP3: | 0.75 |
| AlogP: | -0.29 | Num_rotatable_bonds: | 8 |
| MolWt: | 279.08 | Num_heavy_atoms: | 16 |
| TPSA: | 142.83 | NumAromaticRings: | 0 |
