Glycoside
GD027592
Name:
NoneFormula:
C15H16O8N2Smiles:
OC[C@@H]1O[C@H](c2nc(-c3ccc4c(c3)OCO4)no2)[C@H](O)[C@H](O)[C@H]1OAglycone:
c1nc(-c2ccc3c(c2)OCO3)no1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.47 |
| AlogP: | -1.02 | Num_rotatable_bonds: | 3 |
| MolWt: | 352.3 | Num_heavy_atoms: | 25 |
| TPSA: | 147.53 | NumAromaticRings: | 2 |
Unique Aglycone
AD18114
Formula: C9H6O3N2
Smiles:
c1nc(-c2ccc3c(c2)OCO3)no1| HBA: | 5 | RingCount: | 3 |
| HBD: | 0 | FractionCSP3: | 0.11 |
| AlogP: | 1.47 | Num_rotatable_bonds: | 1 |
| MolWt: | 190.16 | Num_heavy_atoms: | 14 |
| TPSA: | 57.38 | NumAromaticRings: | 2 |
