Glycoside

GD000595
Name:
NoneFormula:
C25H32O7Smiles:
CO[C@@H]1O[C@H](COc2ccccc2)[C@H](O)[C@H](O)[C@H]1Oc1ccc(OC2CCCCC2)cc1Aglycone:
COc1ccccc1.Oc1ccc(OC2CCCCC2)cc1Sugarmoiety:
COC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
HBA: | 7 | RingCount: | 4 |
HBD: | 2 | FractionCSP3: | 0.52 |
AlogP: | 3.32 | Num_rotatable_bonds: | 8 |
MolWt: | 444.52 | Num_heavy_atoms: | 32 |
TPSA: | 86.61 | NumAromaticRings: | 2 |
Unique Aglycone
AD00247
Formula: C7H8O
Smiles:
COc1ccccc1HBA: | 1 | RingCount: | 1 |
HBD: | 0 | FractionCSP3: | 0.14 |
AlogP: | 1.7 | Num_rotatable_bonds: | 1 |
MolWt: | 108.14 | Num_heavy_atoms: | 8 |
TPSA: | 9.23 | NumAromaticRings: | 1 |
AD00645
Formula: C12H16O2
Smiles:
Oc1ccc(OC2CCCCC2)cc1HBA: | 2 | RingCount: | 2 |
HBD: | 1 | FractionCSP3: | 0.5 |
AlogP: | 3.1 | Num_rotatable_bonds: | 2 |
MolWt: | 192.26 | Num_heavy_atoms: | 14 |
TPSA: | 29.46 | NumAromaticRings: | 1 |