Glycoside
GD051911
Name:
NoneFormula:
C16H21O5N2Smiles:
Cc1cc2cc(N[C@H]3[C@H](O)O[C@H](CO)[C@@H](O)[C@@H]3O)ccc2c[nH+]1Aglycone:
Cc1cc2cc(N)ccc2c[nH+]1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.44 |
| AlogP: | -0.83 | Num_rotatable_bonds: | 3 |
| MolWt: | 321.35 | Num_heavy_atoms: | 23 |
| TPSA: | 116.32 | NumAromaticRings: | 2 |
Unique Aglycone
AD27047
Formula: C10H11N2
Smiles:
Cc1cc2cc(N)ccc2c[nH+]1| HBA: | 2 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.1 |
| AlogP: | 1.54 | Num_rotatable_bonds: | 0 |
| MolWt: | 159.21 | Num_heavy_atoms: | 12 |
| TPSA: | 40.16 | NumAromaticRings: | 2 |
