Glycoside
GD090438
Name:
NoneFormula:
C22H25O6N3Smiles:
CCn1c([C@H](NC(=O)C(=O)[C@H](O)[C@H](O)[C@H](O)CO)c2ccccc2)nc2ccccc21Aglycone:
CCn1c(C(N)c2ccccc2)nc2ccccc21Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.32 |
| AlogP: | -0.09 | Num_rotatable_bonds: | 9 |
| MolWt: | 427.46 | Num_heavy_atoms: | 31 |
| TPSA: | 144.91 | NumAromaticRings: | 3 |
Unique Aglycone
AD39348
Formula: C16H17N3
Smiles:
CCn1c(C(N)c2ccccc2)nc2ccccc21| HBA: | 3 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.19 |
| AlogP: | 3.1 | Num_rotatable_bonds: | 3 |
| MolWt: | 251.33 | Num_heavy_atoms: | 19 |
| TPSA: | 43.84 | NumAromaticRings: | 3 |
