Glycoside
GD070541
Name:
NoneFormula:
C19H21O5N2Smiles:
OC[C@@H]1O[C@H](O)[C@H](Nc2c3ccccc3[nH+]c3ccccc23)[C@@H](O)[C@@H]1OAglycone:
Nc1c2ccccc2[nH+]c2ccccc12Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 4 |
| HBD: | 6 | FractionCSP3: | 0.32 |
| AlogP: | 0.02 | Num_rotatable_bonds: | 3 |
| MolWt: | 357.39 | Num_heavy_atoms: | 26 |
| TPSA: | 116.32 | NumAromaticRings: | 3 |
Unique Aglycone
AD33438
Formula: C13H11N2
Smiles:
Nc1c2ccccc2[nH+]c2ccccc12| HBA: | 2 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.0 |
| AlogP: | 2.39 | Num_rotatable_bonds: | 0 |
| MolWt: | 195.25 | Num_heavy_atoms: | 15 |
| TPSA: | 40.16 | NumAromaticRings: | 3 |
