Glycoside
GD037083
Name:
NoneFormula:
C24H25O9N3Smiles:
O=C1Nc2ccc(O)cc2C1=C1Nc2ccccc2C1=NOCCO[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1OAglycone:
O=C1Nc2ccc(O)cc2C1=C1Nc2ccccc2C1=NOCCOSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 5 |
| HBD: | 7 | FractionCSP3: | 0.33 |
| AlogP: | -0.28 | Num_rotatable_bonds: | 6 |
| MolWt: | 499.48 | Num_heavy_atoms: | 36 |
| TPSA: | 182.33 | NumAromaticRings: | 2 |
Unique Aglycone
AD23385
Formula: C18H15O4N3
Smiles:
O=C1Nc2ccc(O)cc2C1=C1Nc2ccccc2C1=NOCCO| HBA: | 7 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.11 |
| AlogP: | 1.89 | Num_rotatable_bonds: | 3 |
| MolWt: | 337.34 | Num_heavy_atoms: | 25 |
| TPSA: | 103.18 | NumAromaticRings: | 2 |
