Glycoside
GD142344
Name:
1-(3,4-dihydroxyphenyl)-5-(4-hydroxy-3-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)pent-4-en-1-oneFormula:
C23H26O10Smiles:
O=C(CCC=Cc1ccc(O)c(OC2OC(CO)C(O)C(O)C2O)c1)c1ccc(O)c(O)c1Aglycone:
O=C(CCC=Cc1ccc(O)c(O)c1)c1ccc(O)c(O)c1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 7 | FractionCSP3: | 0.35 |
| AlogP: | 0.66 | Num_rotatable_bonds: | 8 |
| MolWt: | 462.45 | Num_heavy_atoms: | 33 |
| TPSA: | 177.14 | NumAromaticRings: | 2 |
Unique Aglycone
AD57286
Formula: C17H16O5
Smiles:
O=C(CCC=Cc1ccc(O)c(O)c1)c1ccc(O)c(O)c1| HBA: | 5 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.12 |
| AlogP: | 3.19 | Num_rotatable_bonds: | 5 |
| MolWt: | 300.31 | Num_heavy_atoms: | 22 |
| TPSA: | 97.99 | NumAromaticRings: | 2 |
