Glycoside
GD153753
Name:
1-{4-methyl-1-phenyl-4H-pyrrolo[3,4-b]quinolin-3-yl}butane-1,2,3,4-tetrolFormula:
C22H22O4N2Smiles:
Cn1c2c(C(O)C(O)C(O)CO)nc(-c3ccccc3)c-2cc2ccccc21Aglycone:
Cn1c2cnc(-c3ccccc3)c-2cc2ccccc21Sugarmoiety:
OCC(O)C(O)C(O)OOther Identifiers
Properties
| HBA: | 6 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.23 |
| AlogP: | 2.09 | Num_rotatable_bonds: | 5 |
| MolWt: | 378.43 | Num_heavy_atoms: | 28 |
| TPSA: | 98.74 | NumAromaticRings: | 2 |
Unique Aglycone
AD61120
Formula: C18H14N2
Smiles:
Cn1c2cnc(-c3ccccc3)c-2cc2ccccc21| HBA: | 2 | RingCount: | 4 |
| HBD: | 0 | FractionCSP3: | 0.06 |
| AlogP: | 4.35 | Num_rotatable_bonds: | 1 |
| MolWt: | 258.32 | Num_heavy_atoms: | 20 |
| TPSA: | 17.82 | NumAromaticRings: | 2 |
