Glycoside

GD028156
Name:
NoneFormula:
C23H24O11Smiles:
COc1cc(C=CC(=O)OC[C@@H]2O[C@H](Oc3ccccc3C(=O)O)[C@H](O)[C@H](O)[C@H]2O)ccc1OAglycone:
COC(=O)C=Cc1ccc(O)c(OC)c1.O=C(O)c1ccccc1OSugarmoiety:
OC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
HBA: | 11 | RingCount: | 3 |
HBD: | 5 | FractionCSP3: | 0.3 |
AlogP: | 0.54 | Num_rotatable_bonds: | 8 |
MolWt: | 476.43 | Num_heavy_atoms: | 34 |
TPSA: | 172.21 | NumAromaticRings: | 2 |
Unique Aglycone
AD00132
Formula: C11H12O4
Smiles:
COC(=O)C=Cc1ccc(O)c(OC)c1HBA: | 4 | RingCount: | 1 |
HBD: | 1 | FractionCSP3: | 0.18 |
AlogP: | 1.59 | Num_rotatable_bonds: | 3 |
MolWt: | 208.21 | Num_heavy_atoms: | 15 |
TPSA: | 55.76 | NumAromaticRings: | 1 |
AD03549
Formula: C7H6O3
Smiles:
O=C(O)c1ccccc1OHBA: | 3 | RingCount: | 1 |
HBD: | 2 | FractionCSP3: | 0.0 |
AlogP: | 1.09 | Num_rotatable_bonds: | 1 |
MolWt: | 138.12 | Num_heavy_atoms: | 10 |
TPSA: | 57.53 | NumAromaticRings: | 1 |