Glycoside
GD130787
Name:
2-{3-hydroxy-5-[2-(4-hydroxy-3-methylphenyl)ethenyl]phenoxy}-6-(hydroxymethyl)oxane-3,4,5-triolFormula:
C21H24O8Smiles:
Cc1cc(C=Cc2cc(O)cc(OC3OC(CO)C(O)C(O)C3O)c2)ccc1OAglycone:
Cc1cc(C=Cc2cc(O)cc(O)c2)ccc1OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.33 |
| AlogP: | 0.76 | Num_rotatable_bonds: | 5 |
| MolWt: | 404.42 | Num_heavy_atoms: | 29 |
| TPSA: | 139.84 | NumAromaticRings: | 2 |
Unique Aglycone
AD52994
Formula: C15H14O3
Smiles:
Cc1cc(C=Cc2cc(O)cc(O)c2)ccc1O| HBA: | 3 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.07 |
| AlogP: | 3.28 | Num_rotatable_bonds: | 2 |
| MolWt: | 242.27 | Num_heavy_atoms: | 18 |
| TPSA: | 60.69 | NumAromaticRings: | 2 |
