Glycoside
GD027018
Name:
NoneFormula:
C27H31O8ClSmiles:
OC[C@@H]1O[C@H](c2cc(Cc3ccc(OCCOC4CC4)cc3)c(Cl)c3c2CCO3)[C@H](O)[C@H](O)[C@H]1OAglycone:
Clc1c(Cc2ccc(OCCOC3CC3)cc2)ccc2c1OCC2Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 5 |
| HBD: | 4 | FractionCSP3: | 0.54 |
| AlogP: | 1.94 | Num_rotatable_bonds: | 9 |
| MolWt: | 506.98 | Num_heavy_atoms: | 35 |
| TPSA: | 117.84 | NumAromaticRings: | 2 |
Unique Aglycone
AD17785
Formula: C21H21O3Cl
Smiles:
Clc1c(Cc2ccc(OCCOC3CC3)cc2)ccc2c1OCC2| HBA: | 3 | RingCount: | 4 |
| HBD: | 0 | FractionCSP3: | 0.4 |
| AlogP: | 4.42 | Num_rotatable_bonds: | 7 |
| MolWt: | 344.84 | Num_heavy_atoms: | 24 |
| TPSA: | 27.69 | NumAromaticRings: | 2 |
