Glycoside
GD115501
Name:
NoneFormula:
C19H21O9NSmiles:
COc1c(OC2OC(CO)C(O)C(O)C2O)ccc2c([O+]C)c3ccoc3nc12Aglycone:
COc1c(O)ccc2c([OH+]C)c3ccoc3nc12Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.42 |
| AlogP: | 0.18 | Num_rotatable_bonds: | 5 |
| MolWt: | 407.38 | Num_heavy_atoms: | 29 |
| TPSA: | 145.94 | NumAromaticRings: | 3 |
Unique Aglycone
AD45566
Formula: C13H12O4N
Smiles:
COc1c(O)ccc2c([OH+]C)c3ccoc3nc12| HBA: | 5 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.15 |
| AlogP: | 2.57 | Num_rotatable_bonds: | 2 |
| MolWt: | 246.24 | Num_heavy_atoms: | 18 |
| TPSA: | 68.29 | NumAromaticRings: | 3 |
