Glycoside
GD094968
Name:
NoneFormula:
C21H33O8N3Smiles:
CCOC[C@@H]1c2c(cnn2CC2CCOCC2)CCN1C(=O)C(=O)[C@H](O)[C@H](O)[C@H](O)COAglycone:
CCOCC1NCCc2cnn(CC3CCOCC3)c21Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.76 |
| AlogP: | -1.58 | Num_rotatable_bonds: | 10 |
| MolWt: | 455.51 | Num_heavy_atoms: | 32 |
| TPSA: | 154.58 | NumAromaticRings: | 1 |
Unique Aglycone
AD40585
Formula: C15H25O2N3
Smiles:
CCOCC1NCCc2cnn(CC3CCOCC3)c21| HBA: | 5 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.8 |
| AlogP: | 1.53 | Num_rotatable_bonds: | 5 |
| MolWt: | 279.38 | Num_heavy_atoms: | 20 |
| TPSA: | 48.31 | NumAromaticRings: | 1 |
