Glycoside
GD065439
Name:
NoneFormula:
C15H17O7N3Smiles:
OC[C@H]1O[C@H](O)[C@H](Nc2ncnc3cc4c(cc23)OCO4)[C@@H](O)[C@@H]1OAglycone:
Nc1ncnc2cc3c(cc12)OCO3Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.47 |
| AlogP: | -1.43 | Num_rotatable_bonds: | 3 |
| MolWt: | 351.32 | Num_heavy_atoms: | 25 |
| TPSA: | 146.42 | NumAromaticRings: | 2 |
Unique Aglycone
AD31467
Formula: C9H7O2N3
Smiles:
Nc1ncnc2cc3c(cc12)OCO3| HBA: | 5 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.11 |
| AlogP: | 0.94 | Num_rotatable_bonds: | 0 |
| MolWt: | 189.17 | Num_heavy_atoms: | 14 |
| TPSA: | 70.26 | NumAromaticRings: | 2 |
