Glycoside

GD020122
Name:
NoneFormula:
C29H28O10Smiles:
O=C(C=Cc1ccccc1)OC[C@@H]1O[C@H](Oc2cc(C=Cc3cc(O)cc(O)c3)ccc2O)[C@H](O)[C@H](O)[C@H]1OAglycone:
COC(=O)C=Cc1ccccc1.Oc1cc(O)cc(C=Cc2ccc(O)c(O)c2)c1Sugarmoiety:
OC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
HBA: | 10 | RingCount: | 4 |
HBD: | 6 | FractionCSP3: | 0.21 |
AlogP: | 2.42 | Num_rotatable_bonds: | 8 |
MolWt: | 536.53 | Num_heavy_atoms: | 39 |
TPSA: | 166.14 | NumAromaticRings: | 3 |
Unique Aglycone
AD00648
Formula: C10H10O2
Smiles:
COC(=O)C=Cc1ccccc1HBA: | 2 | RingCount: | 1 |
HBD: | 0 | FractionCSP3: | 0.1 |
AlogP: | 1.87 | Num_rotatable_bonds: | 2 |
MolWt: | 162.19 | Num_heavy_atoms: | 12 |
TPSA: | 26.3 | 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 |