Glycoside

GD018594
Name:
NoneFormula:
C27H26O11Smiles:
O=C(OC[C@@H]1O[C@H](Oc2cc(C=Cc3cc(O)cc(O)c3)ccc2O)[C@H](O)[C@H](O)[C@H]1O)c1ccc(O)cc1Aglycone:
COC(=O)c1ccc(O)cc1.Oc1cc(O)cc(C=Cc2ccc(O)c(O)c2)c1Sugarmoiety:
OC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
HBA: | 11 | RingCount: | 4 |
HBD: | 7 | FractionCSP3: | 0.22 |
AlogP: | 1.72 | Num_rotatable_bonds: | 7 |
MolWt: | 526.49 | Num_heavy_atoms: | 38 |
TPSA: | 186.37 | NumAromaticRings: | 3 |
Unique Aglycone
AD00517
Formula: C8H8O3
Smiles:
COC(=O)c1ccc(O)cc1HBA: | 3 | RingCount: | 1 |
HBD: | 1 | FractionCSP3: | 0.12 |
AlogP: | 1.18 | Num_rotatable_bonds: | 1 |
MolWt: | 152.15 | Num_heavy_atoms: | 11 |
TPSA: | 46.53 | NumAromaticRings: | 1 |
AD01709
Formula: C14H12O4
Smiles:
Oc1cc(O)cc(C=Cc2ccc(O)c(O)c2)c1HBA: | 4 | RingCount: | 2 |
HBD: | 4 | FractionCSP3: | 0.0 |
AlogP: | 2.68 | Num_rotatable_bonds: | 2 |
MolWt: | 244.25 | Num_heavy_atoms: | 18 |
TPSA: | 80.92 | NumAromaticRings: | 2 |