Glycoside

GD137756
Name:
1,6,8-trihydroxy-4-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-2,3,4,9-tetrahydro-1H-xanthen-9-oneFormula:
C19H22O11Smiles:
O=c1c2c(oc3cc(O)cc(O)c13)C(OC1OC(CO)C(O)C(O)C1O)CCC2OAglycone:
O=c1c2c(oc3cc(O)cc(O)c13)C(O)CCC2OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
HBA: | 11 | RingCount: | 4 |
HBD: | 7 | FractionCSP3: | 0.53 |
AlogP: | -1.11 | Num_rotatable_bonds: | 3 |
MolWt: | 426.37 | Num_heavy_atoms: | 30 |
TPSA: | 190.28 | NumAromaticRings: | 2 |
Unique Aglycone
AD55637
Formula: C13H12O6
Smiles:
O=c1c2c(oc3cc(O)cc(O)c13)C(O)CCC2OHBA: | 6 | RingCount: | 3 |
HBD: | 4 | FractionCSP3: | 0.31 |
AlogP: | 1.06 | Num_rotatable_bonds: | 0 |
MolWt: | 264.23 | Num_heavy_atoms: | 19 |
TPSA: | 111.13 | NumAromaticRings: | 2 |