Glycoside
GD093318
Name:
NoneFormula:
C22H24O8N2Smiles:
CCOC(=O)[C@H](OC(=O)Nc1ccccc1)[C@@H](OC(=O)Nc1ccccc1)C(=O)OCCAglycone:
O=CNc1ccccc1.O=CNc1ccccc1Sugarmoiety:
CCOC(=O)C(OO)C(OO)C(=O)OCCOther Identifiers
Properties
| HBA: | 10 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.27 |
| AlogP: | 3.35 | Num_rotatable_bonds: | 9 |
| MolWt: | 444.44 | Num_heavy_atoms: | 32 |
| TPSA: | 129.26 | NumAromaticRings: | 2 |
Unique Aglycone
AD01120
Formula: C7H7ON
Smiles:
O=CNc1ccccc1| HBA: | 2 | RingCount: | 1 |
| HBD: | 1 | FractionCSP3: | 0.0 |
| AlogP: | 1.25 | Num_rotatable_bonds: | 2 |
| MolWt: | 121.14 | Num_heavy_atoms: | 9 |
| TPSA: | 29.1 | NumAromaticRings: | 1 |
