Glycoside
GD081009
Name:
NoneFormula:
C19H26O7N4Smiles:
CC(=O)N[C@H]1[C@H](OCCn2cc(COc3ccccc3)nn2)O[C@H](CO)[C@@H](O)[C@@H]1OAglycone:
OCCn1cc(COc2ccccc2)nn1Sugarmoiety:
CC(=O)NC1C(O)OC(CO)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.53 |
| AlogP: | -1.18 | Num_rotatable_bonds: | 9 |
| MolWt: | 422.44 | Num_heavy_atoms: | 30 |
| TPSA: | 148.19 | NumAromaticRings: | 2 |
Unique Aglycone
AD34195
Formula: C11H13O2N3
Smiles:
OCCn1cc(COc2ccccc2)nn1| HBA: | 5 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.27 |
| AlogP: | 0.85 | Num_rotatable_bonds: | 5 |
| MolWt: | 219.24 | Num_heavy_atoms: | 16 |
| TPSA: | 60.17 | NumAromaticRings: | 2 |
