Glycoside
GD090808
Name:
NoneFormula:
C21H25O7N3Smiles:
COc1ccc(Cn2cc3[nH]c(N[C@H]4[C@@H](O)O[C@H](CO)[C@@H](O)[C@@H]4O)ccc-3c2=O)cc1Aglycone:
COc1ccc(Cn2cc3[nH]c(N)ccc-3c2=O)cc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 6 | FractionCSP3: | 0.38 |
| AlogP: | -0.45 | Num_rotatable_bonds: | 6 |
| MolWt: | 431.45 | Num_heavy_atoms: | 31 |
| TPSA: | 149.2 | NumAromaticRings: | 1 |
Unique Aglycone
AD39532
Formula: C15H15O2N3
Smiles:
COc1ccc(Cn2cc3[nH]c(N)ccc-3c2=O)cc1| HBA: | 5 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.13 |
| AlogP: | 1.92 | Num_rotatable_bonds: | 3 |
| MolWt: | 269.3 | Num_heavy_atoms: | 20 |
| TPSA: | 73.04 | NumAromaticRings: | 1 |
