Glycoside
GD079465
Name:
NoneFormula:
C21H31O6N3Smiles:
CN(Cc1ccncc1)C1CC2(CCN(C(=O)C(=O)[C@H](O)[C@H](O)[C@H](O)CO)CC2)C1Aglycone:
CN(Cc1ccncc1)C1CC2(CCNCC2)C1Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.67 |
| AlogP: | -1.07 | Num_rotatable_bonds: | 8 |
| MolWt: | 421.49 | Num_heavy_atoms: | 30 |
| TPSA: | 134.43 | NumAromaticRings: | 1 |
Unique Aglycone
AD36329
Formula: C15H23N3
Smiles:
CN(Cc1ccncc1)C1CC2(CCNCC2)C1| HBA: | 3 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.67 |
| AlogP: | 2.05 | Num_rotatable_bonds: | 3 |
| MolWt: | 245.37 | Num_heavy_atoms: | 18 |
| TPSA: | 28.16 | NumAromaticRings: | 1 |
