Glycoside
GD026128
Name:
2-(4-{[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxy}-3-hydroxyphenyl)-3,5,7-trihydroxy-4H-chromen-4-oneFormula:
C20H18O11Smiles:
O=c1c(O)c(-c2ccc(O[C@@H]3O[C@H](CO)[C@H](O)[C@H]3O)c(O)c2)oc2cc(O)cc(O)c12Aglycone:
O=c1c(O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 4 |
| HBD: | 7 | FractionCSP3: | 0.25 |
| AlogP: | 0.1 | Num_rotatable_bonds: | 4 |
| MolWt: | 434.35 | Num_heavy_atoms: | 31 |
| TPSA: | 190.28 | NumAromaticRings: | 3 |
Unique Aglycone
AD00377
Formula: C15H10O7
Smiles:
O=c1c(O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12| HBA: | 7 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.0 |
| AlogP: | 1.99 | Num_rotatable_bonds: | 1 |
| MolWt: | 302.24 | Num_heavy_atoms: | 22 |
| TPSA: | 131.36 | NumAromaticRings: | 3 |
