Glycoside
GD065810
Name:
NoneFormula:
C16H19O8NSmiles:
O=C(C(=O)N1CCc2cc3c(cc2C1)OCO3)[C@H](O)[C@H](O)[C@H](O)COAglycone:
c1c2c(cc3c1OCO3)CNCC2Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.5 |
| AlogP: | -2.06 | Num_rotatable_bonds: | 5 |
| MolWt: | 353.33 | Num_heavy_atoms: | 25 |
| TPSA: | 136.76 | NumAromaticRings: | 1 |
Unique Aglycone
AD31654
Formula: C10H11O2N
Smiles:
c1c2c(cc3c1OCO3)CNCC2| HBA: | 3 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.4 |
| AlogP: | 1.06 | Num_rotatable_bonds: | 0 |
| MolWt: | 177.2 | Num_heavy_atoms: | 13 |
| TPSA: | 30.49 | NumAromaticRings: | 1 |
