Glycoside
GD073447
Name:
NoneFormula:
C18H24O8N2Smiles:
O=C(C(=O)N1CCN(Cc2ccc3c(c2)OCO3)CC1)[C@H](O)[C@@H](O)[C@H](O)COAglycone:
c1cc2c(cc1CN1CCNCC1)OCO2Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.56 |
| AlogP: | -2.3 | Num_rotatable_bonds: | 7 |
| MolWt: | 396.4 | Num_heavy_atoms: | 28 |
| TPSA: | 140.0 | NumAromaticRings: | 1 |
Unique Aglycone
AD34048
Formula: C12H16O2N2
Smiles:
c1cc2c(cc1CN1CCNCC1)OCO2| HBA: | 4 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.5 |
| AlogP: | 0.82 | Num_rotatable_bonds: | 2 |
| MolWt: | 220.27 | Num_heavy_atoms: | 16 |
| TPSA: | 33.73 | NumAromaticRings: | 1 |
