Glycoside
GD032492
Name:
NoneFormula:
C17H21O6N3Smiles:
COc1ccc(CNc2ccn(C3OC(CO)C(O)C3O)c(=O)n2)cc1Aglycone:
COc1ccc(CNc2cc[nH]c(=O)n2)cc1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.41 |
| AlogP: | -0.52 | Num_rotatable_bonds: | 6 |
| MolWt: | 363.37 | Num_heavy_atoms: | 26 |
| TPSA: | 126.07 | NumAromaticRings: | 2 |
Unique Aglycone
AD20836
Formula: C12H13O2N3
Smiles:
COc1ccc(CNc2cc[nH]c(=O)n2)cc1| HBA: | 5 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.17 |
| AlogP: | 1.39 | Num_rotatable_bonds: | 4 |
| MolWt: | 231.26 | Num_heavy_atoms: | 17 |
| TPSA: | 67.01 | NumAromaticRings: | 2 |
