Glycoside
GD022979
Name:
NoneFormula:
C24H28O7N4Smiles:
O=C1Nc2ccccc2C1=C1Nc2ccccc2C1=NOCCNCC(O)C(O)C(O)C(O)COAglycone:
CNCCON=C1C(=C2C(=O)Nc3ccccc32)Nc2ccccc21Sugarmoiety:
OCC(O)C(O)C(O)C(O)OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 4 |
| HBD: | 8 | FractionCSP3: | 0.33 |
| AlogP: | -0.78 | Num_rotatable_bonds: | 10 |
| MolWt: | 484.51 | Num_heavy_atoms: | 35 |
| TPSA: | 175.9 | NumAromaticRings: | 2 |
Unique Aglycone
AD15504
Formula: C19H18O2N4
Smiles:
CNCCON=C1C(=C2C(=O)Nc3ccccc32)Nc2ccccc21| HBA: | 6 | RingCount: | 4 |
| HBD: | 3 | FractionCSP3: | 0.16 |
| AlogP: | 2.42 | Num_rotatable_bonds: | 4 |
| MolWt: | 334.38 | Num_heavy_atoms: | 25 |
| TPSA: | 74.75 | NumAromaticRings: | 2 |
