Glycoside

GD119669
Name:
NoneFormula:
C31H30O13Smiles:
COc1cc(C=CC(=O)OC2=Cc3c(OC4OC(CO)C(O)C(O)C4O)cc(O)cc3[OH+]C2=C2C=C[C](O)C=C2)ccc1OAglycone:
COc1cc(C=CC(=O)OC2=Cc3c(O)cc(O)cc3[OH+]C2=C2C=CC(O)C=C2)ccc1OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
HBA: | 13 | RingCount: | 5 |
HBD: | 8 | FractionCSP3: | 0.23 |
AlogP: | 1.42 | Num_rotatable_bonds: | 7 |
MolWt: | 610.57 | Num_heavy_atoms: | 44 |
TPSA: | 208.4 | NumAromaticRings: | 2 |
Unique Aglycone
AD47989
Formula: C25H21O8
Smiles:
COc1cc(C=CC(=O)OC2=Cc3c(O)cc(O)cc3[OH+]C2=C2C=CC(O)C=C2)ccc1OHBA: | 8 | RingCount: | 4 |
HBD: | 5 | FractionCSP3: | 0.08 |
AlogP: | 3.41 | Num_rotatable_bonds: | 4 |
MolWt: | 449.44 | Num_heavy_atoms: | 33 |
TPSA: | 129.25 | NumAromaticRings: | 2 |