Glycoside
GD148951
Name:
11-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-2H,10H-[1,3]dioxolo[4,5-b]xanthen-10-oneFormula:
C20H18O10Smiles:
O=c1c2ccccc2oc2cc3c(c(OC4OC(CO)C(O)C(O)C4O)c12)OCO3Aglycone:
O=c1c2ccccc2oc2cc3c(c(O)c12)OCO3Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 5 |
| HBD: | 4 | FractionCSP3: | 0.35 |
| AlogP: | -0.15 | Num_rotatable_bonds: | 3 |
| MolWt: | 418.35 | Num_heavy_atoms: | 30 |
| TPSA: | 148.05 | NumAromaticRings: | 3 |
Unique Aglycone
AD59575
Formula: C14H8O5
Smiles:
O=c1c2ccccc2oc2cc3c(c(O)c12)OCO3| HBA: | 5 | RingCount: | 4 |
| HBD: | 1 | FractionCSP3: | 0.07 |
| AlogP: | 2.38 | Num_rotatable_bonds: | 0 |
| MolWt: | 256.21 | Num_heavy_atoms: | 19 |
| TPSA: | 68.9 | NumAromaticRings: | 3 |
