Glycoside
GD057014
Name:
NoneFormula:
C14H14O8N2Smiles:
O=C(c1nc(-c2ccc3c(c2)OCO3)no1)[C@H](O)[C@@H](O)[C@H](O)COAglycone:
c1nc(-c2ccc3c(c2)OCO3)no1Sugarmoiety:
O=C(O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.36 |
| AlogP: | -1.28 | Num_rotatable_bonds: | 6 |
| MolWt: | 338.27 | Num_heavy_atoms: | 24 |
| TPSA: | 155.37 | 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 |
