Glycoside
GD152350
Name:
Glucodichotomine BFormula:
C20H22O9N2Smiles:
O=C(O)c1cc2c([nH]c3ccccc32)c(C(CO)OC2OC(CO)C(O)C(O)C2O)n1Aglycone:
O=C(O)c1cc2c([nH]c3ccccc32)c(C(O)CO)n1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 4 |
| HBD: | 7 | FractionCSP3: | 0.4 |
| AlogP: | -0.74 | Num_rotatable_bonds: | 6 |
| MolWt: | 434.4 | Num_heavy_atoms: | 31 |
| TPSA: | 185.59 | NumAromaticRings: | 3 |
Unique Aglycone
AD60674
Formula: C14H12O4N2
Smiles:
O=C(O)c1cc2c([nH]c3ccccc32)c(C(O)CO)n1| HBA: | 6 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.14 |
| AlogP: | 1.44 | Num_rotatable_bonds: | 3 |
| MolWt: | 272.26 | Num_heavy_atoms: | 20 |
| TPSA: | 106.44 | NumAromaticRings: | 3 |
