Glycoside
GD126759
Name:
2-{[1-(1,2-dihydroxyethyl)-9H-pyrido[3,4-b]indol-3-yl]methoxy}-6-(hydroxymethyl)oxane-3,4,5-triolFormula:
C20H24O8N2Smiles:
OCC(O)c1nc(COC2OC(CO)C(O)C(O)C2O)cc2c1[nH]c1ccccc12Aglycone:
OCc1cc2c([nH]c3ccccc32)c(C(O)CO)n1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 7 | FractionCSP3: | 0.45 |
| AlogP: | -0.94 | Num_rotatable_bonds: | 6 |
| MolWt: | 420.42 | Num_heavy_atoms: | 30 |
| TPSA: | 168.52 | NumAromaticRings: | 3 |
Unique Aglycone
AD50840
Formula: C14H14O3N2
Smiles:
OCc1cc2c([nH]c3ccccc32)c(C(O)CO)n1| HBA: | 5 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.21 |
| AlogP: | 1.23 | Num_rotatable_bonds: | 3 |
| MolWt: | 258.28 | Num_heavy_atoms: | 19 |
| TPSA: | 89.37 | NumAromaticRings: | 3 |
