Glycoside
GD009776
Name:
NoneFormula:
C19H21O7N3Smiles:
O=C(NCc1ccco1)c1ccc2[nH]c([C@@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3O)nc2c1Aglycone:
O=C(NCc1ccco1)c1ccc2[nH]cnc2c1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 6 | FractionCSP3: | 0.37 |
| AlogP: | -0.4 | Num_rotatable_bonds: | 5 |
| MolWt: | 403.39 | Num_heavy_atoms: | 29 |
| TPSA: | 161.07 | NumAromaticRings: | 3 |
Unique Aglycone
AD07637
Formula: C13H11O2N3
Smiles:
O=C(NCc1ccco1)c1ccc2[nH]cnc2c1| HBA: | 5 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.08 |
| AlogP: | 2.09 | Num_rotatable_bonds: | 3 |
| MolWt: | 241.25 | Num_heavy_atoms: | 18 |
| TPSA: | 70.92 | NumAromaticRings: | 3 |
