Glycoside
GD151431
Name:
6-[2-(3,4-dihydroxyphenyl)ethenyl]-4-hydroxy-3-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-2H-pyran-2-oneFormula:
C19H20O11Smiles:
O=c1oc(C=Cc2ccc(O)c(O)c2)cc(O)c1OC1OC(CO)C(O)C(O)C1OAglycone:
O=c1oc(C=Cc2ccc(O)c(O)c2)cc(O)c1OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 7 | FractionCSP3: | 0.32 |
| AlogP: | -0.89 | Num_rotatable_bonds: | 5 |
| MolWt: | 424.36 | Num_heavy_atoms: | 30 |
| TPSA: | 190.28 | NumAromaticRings: | 2 |
Unique Aglycone
AD60397
Formula: C13H10O6
Smiles:
O=c1oc(C=Cc2ccc(O)c(O)c2)cc(O)c1O| HBA: | 6 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.0 |
| AlogP: | 1.63 | Num_rotatable_bonds: | 2 |
| MolWt: | 262.22 | Num_heavy_atoms: | 19 |
| TPSA: | 111.13 | NumAromaticRings: | 2 |
