Glycoside
GD030021
Name:
NoneFormula:
C22H28O8N2Smiles:
Nc1ccc(CCNCC(O)c2ccccc2)cc1O[C@@H]1O[C@H](C(=O)O)[C@H](O)[C@H](O)[C@H]1OAglycone:
Nc1ccc(CCNCC(O)c2ccccc2)cc1OSugarmoiety:
O=C(O)C1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 8 | FractionCSP3: | 0.41 |
| AlogP: | -0.59 | Num_rotatable_bonds: | 9 |
| MolWt: | 448.47 | Num_heavy_atoms: | 32 |
| TPSA: | 174.73 | NumAromaticRings: | 2 |
Unique Aglycone
AD19460
Formula: C16H20O2N2
Smiles:
Nc1ccc(CCNCC(O)c2ccccc2)cc1O| HBA: | 4 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.25 |
| AlogP: | 1.84 | Num_rotatable_bonds: | 6 |
| MolWt: | 272.35 | Num_heavy_atoms: | 20 |
| TPSA: | 78.51 | NumAromaticRings: | 2 |
