Glycoside
GD032060
Name:
NoneFormula:
C15H23O10N5P2Smiles:
Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OC2CCCC2)[C@H](O)[C@H]1OAglycone:
COP(=O)(O)OP(=O)(O)OC1CCCC1.Nc1ncnc2c1N=C[N]2Sugarmoiety:
OC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 15 | RingCount: | 4 |
| HBD: | 6 | FractionCSP3: | 0.67 |
| AlogP: | 0.22 | Num_rotatable_bonds: | 8 |
| MolWt: | 495.32 | Num_heavy_atoms: | 32 |
| TPSA: | 221.6 | NumAromaticRings: | 2 |
Unique Aglycone
AD00058
Formula: C5H4N5
Smiles:
Nc1ncnc2c1N=C[N]2| HBA: | 5 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | -0.03 | Num_rotatable_bonds: | 0 |
| MolWt: | 134.12 | Num_heavy_atoms: | 10 |
| TPSA: | 78.26 | NumAromaticRings: | 1 |
AD20591
Formula: C6H14O7P2
Smiles:
COP(=O)(O)OP(=O)(O)OC1CCCC1| HBA: | 7 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 1.0 |
| AlogP: | 1.81 | Num_rotatable_bonds: | 5 |
| MolWt: | 260.12 | Num_heavy_atoms: | 15 |
| TPSA: | 102.29 | NumAromaticRings: | 0 |
