Glycoside
GD155307
Name:
2-(hydroxymethyl)-6-{2,4,6-trihydroxy-3-[1-hydroxy-3-(4-hydroxyphenyl)prop-2-en-1-yl]phenoxy}oxane-3,4,5-triolFormula:
C21H24O11Smiles:
OCC1OC(Oc2c(O)cc(O)c(C(O)C=Cc3ccc(O)cc3)c2O)C(O)C(O)C1OAglycone:
Oc1ccc(C=CC(O)c2c(O)cc(O)c(O)c2O)cc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 9 | FractionCSP3: | 0.33 |
| AlogP: | -0.57 | Num_rotatable_bonds: | 6 |
| MolWt: | 452.41 | Num_heavy_atoms: | 32 |
| TPSA: | 200.53 | NumAromaticRings: | 2 |
Unique Aglycone
AD61611
Formula: C15H14O6
Smiles:
Oc1ccc(C=CC(O)c2c(O)cc(O)c(O)c2O)cc1| HBA: | 6 | RingCount: | 2 |
| HBD: | 6 | FractionCSP3: | 0.07 |
| AlogP: | 1.96 | Num_rotatable_bonds: | 3 |
| MolWt: | 290.27 | Num_heavy_atoms: | 21 |
| TPSA: | 121.38 | NumAromaticRings: | 2 |
