Glycoside
GD025823
Name:
NoneFormula:
C9H16O8N3PSmiles:
O=P(O)(O)OC[C@@H]1O[C@H](n2cc(CCO)nn2)[C@H](O)[C@H]1OAglycone:
COP(=O)(O)O.OCCC1=C[N]N=N1Sugarmoiety:
OC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.78 |
| AlogP: | -2.46 | Num_rotatable_bonds: | 6 |
| MolWt: | 325.21 | Num_heavy_atoms: | 21 |
| TPSA: | 167.39 | NumAromaticRings: | 1 |
Unique Aglycone
AD00079
Formula: CH5O4P
Smiles:
COP(=O)(O)O| HBA: | 4 | RingCount: | 0 |
| HBD: | 2 | FractionCSP3: | 1.0 |
| AlogP: | -0.27 | Num_rotatable_bonds: | 1 |
| MolWt: | 112.02 | Num_heavy_atoms: | 6 |
| TPSA: | 66.76 | NumAromaticRings: | 0 |
AD17086
Formula: C4H6ON3
Smiles:
OCCC1=C[N]N=N1| HBA: | 4 | RingCount: | 1 |
| HBD: | 1 | FractionCSP3: | 0.5 |
| AlogP: | 0.2 | Num_rotatable_bonds: | 2 |
| MolWt: | 112.11 | Num_heavy_atoms: | 8 |
| TPSA: | 59.05 | NumAromaticRings: | 0 |
