Glycoside
GD086344
Name:
NoneFormula:
C11H20O10N4P2Smiles:
CC1=NC=N[C@@H]2[C@@H]1N=CN2[C@H]1O[C@@H](CO[PH](O)(O)OP(=O)(O)O)[C@H](O)[C@@H]1OAglycone:
CC1=NC=NC2NC=NC12.CO[PH](O)(O)OP(=O)(O)OSugarmoiety:
OC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 14 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.73 |
| AlogP: | -2.51 | Num_rotatable_bonds: | 6 |
| MolWt: | 430.25 | Num_heavy_atoms: | 27 |
| TPSA: | 206.46 | NumAromaticRings: | 0 |
Unique Aglycone
AD36266
Formula: CH8O7P2
Smiles:
CO[PH](O)(O)OP(=O)(O)O| HBA: | 7 | RingCount: | 0 |
| HBD: | 4 | FractionCSP3: | 1.0 |
| AlogP: | -0.86 | Num_rotatable_bonds: | 3 |
| MolWt: | 194.02 | Num_heavy_atoms: | 10 |
| TPSA: | 116.45 | NumAromaticRings: | 0 |
AD38283
Formula: C6H8N4
Smiles:
CC1=NC=NC2NC=NC12| HBA: | 4 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.5 |
| AlogP: | -0.18 | Num_rotatable_bonds: | 0 |
| MolWt: | 136.16 | Num_heavy_atoms: | 10 |
| TPSA: | 49.11 | NumAromaticRings: | 0 |
