Glycoside
GD121740
Name:
6-({5,19-dimethyl-15,18,20-trioxahexacyclo[14.5.1.0¹,¹â´.0â´,¹³.0âµ,¹â°.0¹â¹,²²]docosa-10,13-dien-8-yl}oxy)-4-methoxy-2-methyloxan-3-olFormula:
C28H40O7Smiles:
COC1CC(OC2CCC3(C)C(=CCC4=C5OC6COC7(C)OCC5(CCC43)C67)C2)OC(C)C1OAglycone:
CC12OCC3OC4=C5CC=C6CC(O)CCC6(C)C5CCC4(CO1)C32Sugarmoiety:
COC1CC(O)OC(C)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 7 |
| HBD: | 1 | FractionCSP3: | 0.86 |
| AlogP: | 3.84 | Num_rotatable_bonds: | 3 |
| MolWt: | 488.62 | Num_heavy_atoms: | 35 |
| TPSA: | 75.61 | NumAromaticRings: | 0 |
Unique Aglycone
AD49015
Formula: C21H28O4
Smiles:
CC12OCC3OC4=C5CC=C6CC(O)CCC6(C)C5CCC4(CO1)C32| HBA: | 4 | RingCount: | 6 |
| HBD: | 1 | FractionCSP3: | 0.81 |
| AlogP: | 3.31 | Num_rotatable_bonds: | 0 |
| MolWt: | 344.45 | Num_heavy_atoms: | 25 |
| TPSA: | 47.92 | NumAromaticRings: | 0 |
