Glycoside

GD128223
Name:
7-hydroxy-6-methoxy-3-[(2-oxo-2H-chromen-7-yl)oxy]-8-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-2H-chromen-2-oneFormula:
C25H22O13Smiles:
COc1cc2cc(Oc3ccc4ccc(=O)oc4c3)c(=O)oc2c(OC2OC(CO)C(O)C(O)C2O)c1OAglycone:
COc1cc2cc(Oc3ccc4ccc(=O)oc4c3)c(=O)oc2c(O)c1OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
HBA: | 13 | RingCount: | 5 |
HBD: | 5 | FractionCSP3: | 0.28 |
AlogP: | 0.58 | Num_rotatable_bonds: | 6 |
MolWt: | 530.44 | Num_heavy_atoms: | 38 |
TPSA: | 198.49 | NumAromaticRings: | 4 |
Unique Aglycone
AD51943
Formula: C19H12O8
Smiles:
COc1cc2cc(Oc3ccc4ccc(=O)oc4c3)c(=O)oc2c(O)c1OHBA: | 8 | RingCount: | 4 |
HBD: | 2 | FractionCSP3: | 0.05 |
AlogP: | 3.11 | Num_rotatable_bonds: | 3 |
MolWt: | 368.3 | Num_heavy_atoms: | 27 |
TPSA: | 119.34 | NumAromaticRings: | 4 |