Glycoside

GD024758
Name:
NoneFormula:
C44H44O6Smiles:
CCC[C@@H]1O[C@H](COCc2ccc3ccccc3c2)[C@H](OCc2ccc3ccccc3c2)[C@H](OCc2ccc3ccccc3c2)[C@H]1OC(C)=OAglycone:
COCc1ccc2ccccc2c1.OCc1ccc2ccccc2c1.OCc1ccc2ccccc2c1Sugarmoiety:
CCCC1OC(O)C(O)C(O)C1OC(C)=OOther Identifiers
Properties
HBA: | 6 | RingCount: | 7 |
HBD: | 0 | FractionCSP3: | 0.3 |
AlogP: | 9.33 | Num_rotatable_bonds: | 13 |
MolWt: | 668.83 | Num_heavy_atoms: | 50 |
TPSA: | 63.22 | NumAromaticRings: | 6 |
Unique Aglycone
AD01045
Formula: C11H10O
Smiles:
OCc1ccc2ccccc2c1HBA: | 1 | RingCount: | 2 |
HBD: | 1 | FractionCSP3: | 0.09 |
AlogP: | 2.33 | Num_rotatable_bonds: | 1 |
MolWt: | 158.2 | Num_heavy_atoms: | 12 |
TPSA: | 20.23 | NumAromaticRings: | 2 |
AD01842
Formula: C12H12O
Smiles:
COCc1ccc2ccccc2c1HBA: | 1 | RingCount: | 2 |
HBD: | 0 | FractionCSP3: | 0.17 |
AlogP: | 2.99 | Num_rotatable_bonds: | 2 |
MolWt: | 172.23 | Num_heavy_atoms: | 13 |
TPSA: | 9.23 | NumAromaticRings: | 2 |