Glycoside
GD153430
Name:
2-{[7-(4-hydroxy-5-methoxy-7-methylnaphthalen-1-yl)-8-methoxy-1,3-dimethyl-3,4-dihydroisoquinolin-6-yl]oxy}-6-methyloxane-3,4,5-triolFormula:
C30H35O8NSmiles:
COc1c2c(cc(OC3OC(C)C(O)C(O)C3O)c1-c1ccc(O)c3c(OC)cc(C)cc13)CC(C)N=C2CAglycone:
COc1c2c(cc(O)c1-c1ccc(O)c3c(OC)cc(C)cc13)CC(C)N=C2CSugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 5 |
| HBD: | 4 | FractionCSP3: | 0.43 |
| AlogP: | 3.5 | Num_rotatable_bonds: | 5 |
| MolWt: | 537.61 | Num_heavy_atoms: | 39 |
| TPSA: | 130.2 | NumAromaticRings: | 3 |
Unique Aglycone
AD61019
Formula: C24H25O4N
Smiles:
COc1c2c(cc(O)c1-c1ccc(O)c3c(OC)cc(C)cc13)CC(C)N=C2C| HBA: | 5 | RingCount: | 4 |
| HBD: | 2 | FractionCSP3: | 0.29 |
| AlogP: | 5.0 | Num_rotatable_bonds: | 3 |
| MolWt: | 391.47 | Num_heavy_atoms: | 29 |
| TPSA: | 71.28 | NumAromaticRings: | 3 |
