Glycoside
GD147133
Name:
2-({7-hydroxy-11-methoxy-2H,4H,5H,10H,11H-indolo[7a,1-a]isoquinolin-8-yl}oxy)-6-(hydroxymethyl)oxane-3,4,5-triolFormula:
C23H29O8NSmiles:
COC1C=CC2=CCN3CCc4cc(O)c(OC5OC(CO)C(O)C(O)C5O)cc4C23C1Aglycone:
COC1C=CC2=CCN3CCc4cc(O)c(O)cc4C23C1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 5 |
| HBD: | 5 | FractionCSP3: | 0.57 |
| AlogP: | -0.46 | Num_rotatable_bonds: | 4 |
| MolWt: | 447.48 | Num_heavy_atoms: | 32 |
| TPSA: | 132.08 | NumAromaticRings: | 1 |
Unique Aglycone
AD51248
Formula: C17H19O3N
Smiles:
COC1C=CC2=CCN3CCc4cc(O)c(O)cc4C23C1| HBA: | 4 | RingCount: | 4 |
| HBD: | 2 | FractionCSP3: | 0.41 |
| AlogP: | 2.07 | Num_rotatable_bonds: | 1 |
| MolWt: | 285.34 | Num_heavy_atoms: | 21 |
| TPSA: | 52.93 | NumAromaticRings: | 1 |
