Glycoside

GD019044
Name:
NoneFormula:
C29H38O6Smiles:
CO[C@@H]1O[C@H](COc2ccc(C3CCCCC3)cc2)[C@H](O)[C@H](O)[C@H]1Oc1cccc2c1CCCC2Aglycone:
COc1ccc(C2CCCCC2)cc1.Oc1cccc2c1CCCC2Sugarmoiety:
COC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
HBA: | 6 | RingCount: | 5 |
HBD: | 2 | FractionCSP3: | 0.59 |
AlogP: | 4.53 | Num_rotatable_bonds: | 7 |
MolWt: | 482.62 | Num_heavy_atoms: | 35 |
TPSA: | 77.38 | NumAromaticRings: | 2 |
Unique Aglycone
AD05441
Formula: C13H18O
Smiles:
COc1ccc(C2CCCCC2)cc1HBA: | 1 | RingCount: | 2 |
HBD: | 0 | FractionCSP3: | 0.54 |
AlogP: | 3.74 | Num_rotatable_bonds: | 2 |
MolWt: | 190.29 | Num_heavy_atoms: | 14 |
TPSA: | 9.23 | NumAromaticRings: | 1 |
AD13342
Formula: C10H12O
Smiles:
Oc1cccc2c1CCCC2HBA: | 1 | RingCount: | 2 |
HBD: | 1 | FractionCSP3: | 0.4 |
AlogP: | 2.27 | Num_rotatable_bonds: | 0 |
MolWt: | 148.2 | Num_heavy_atoms: | 11 |
TPSA: | 20.23 | NumAromaticRings: | 1 |