Glycoside
GD002721
Name:
NoneFormula:
C10H18O15N5P3Smiles:
O=C1NNC(=O)C2C(N=CN2C2O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@H](O)[C@H]2O)N1Aglycone:
COP(=O)(O)OP(=O)(O)OP(=O)(O)O.O=C1NNC(=O)C2NC=NC2N1Sugarmoiety:
OC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 20 | RingCount: | 3 |
| HBD: | 9 | FractionCSP3: | 0.7 |
| AlogP: | -3.84 | Num_rotatable_bonds: | 8 |
| MolWt: | 541.2 | Num_heavy_atoms: | 33 |
| TPSA: | 295.34 | NumAromaticRings: | 0 |
Unique Aglycone
AD00534
Formula: CH7O10P3
Smiles:
COP(=O)(O)OP(=O)(O)OP(=O)(O)O| HBA: | 10 | RingCount: | 0 |
| HBD: | 4 | FractionCSP3: | 1.0 |
| AlogP: | -0.04 | Num_rotatable_bonds: | 5 |
| MolWt: | 271.98 | Num_heavy_atoms: | 14 |
| TPSA: | 159.82 | NumAromaticRings: | 0 |
AD02561
Formula: C5H7O2N5
Smiles:
O=C1NNC(=O)C2NC=NC2N1| HBA: | 7 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.4 |
| AlogP: | -2.34 | Num_rotatable_bonds: | 0 |
| MolWt: | 169.14 | Num_heavy_atoms: | 12 |
| TPSA: | 94.62 | NumAromaticRings: | 0 |
