Glycoside
GD148474
Name:
2-({8,11-dimethoxy-2H,4H,5H,10H,11H,12H,13H-indolo[7a,1-a]isoquinolin-7-yl}oxy)-6-(hydroxymethyl)oxane-3,4,5-triolFormula:
C24H33O8NSmiles:
COc1cc2c(cc1OC1OC(CO)C(O)C(O)C1O)CCN1CC=C3CCC(OC)CC321Aglycone:
COc1cc2c(cc1O)CCN1CC=C3CCC(OC)CC321Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 5 |
| HBD: | 4 | FractionCSP3: | 0.67 |
| AlogP: | 0.07 | Num_rotatable_bonds: | 5 |
| MolWt: | 463.53 | Num_heavy_atoms: | 33 |
| TPSA: | 121.08 | NumAromaticRings: | 1 |
Unique Aglycone
AD59409
Formula: C18H23O3N
Smiles:
COc1cc2c(cc1O)CCN1CC=C3CCC(OC)CC321| HBA: | 4 | RingCount: | 4 |
| HBD: | 1 | FractionCSP3: | 0.56 |
| AlogP: | 2.59 | Num_rotatable_bonds: | 2 |
| MolWt: | 301.39 | Num_heavy_atoms: | 22 |
| TPSA: | 41.93 | NumAromaticRings: | 1 |
