Glycoside
GD081778
Name:
NoneFormula:
C20H28O6N4Smiles:
CCn1c(N2CCC[C@H](NC(=O)C(=O)[C@H](O)[C@@H](O)[C@@H](O)CO)C2)nc2ccccc21Aglycone:
CCn1c(N2CCCC(N)C2)nc2ccccc21Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.55 |
| AlogP: | -1.21 | Num_rotatable_bonds: | 8 |
| MolWt: | 420.47 | Num_heavy_atoms: | 30 |
| TPSA: | 148.15 | NumAromaticRings: | 2 |
Unique Aglycone
AD36762
Formula: C14H20N4
Smiles:
CCn1c(N2CCCC(N)C2)nc2ccccc21| HBA: | 4 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.5 |
| AlogP: | 1.98 | Num_rotatable_bonds: | 2 |
| MolWt: | 244.34 | Num_heavy_atoms: | 18 |
| TPSA: | 47.08 | NumAromaticRings: | 2 |
