Glycoside
GD147150
Name:
2-{2-[1-(3,4-dihydroxyphenyl)ethenyl]-3-hydroxy-5-methoxyphenoxy}-6-(hydroxymethyl)oxane-3,4,5-triolFormula:
C21H24O10Smiles:
C=C(c1ccc(O)c(O)c1)c1c(O)cc(OC)cc1OC1OC(CO)C(O)C(O)C1OAglycone:
C=C(c1ccc(O)c(O)c1)c1c(O)cc(OC)cc1OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 7 | FractionCSP3: | 0.33 |
| AlogP: | 0.05 | Num_rotatable_bonds: | 6 |
| MolWt: | 436.41 | Num_heavy_atoms: | 31 |
| TPSA: | 169.3 | NumAromaticRings: | 2 |
Unique Aglycone
AD58941
Formula: C15H14O5
Smiles:
C=C(c1ccc(O)c(O)c1)c1c(O)cc(OC)cc1O| HBA: | 5 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.07 |
| AlogP: | 2.58 | Num_rotatable_bonds: | 3 |
| MolWt: | 274.27 | Num_heavy_atoms: | 20 |
| TPSA: | 90.15 | NumAromaticRings: | 2 |
