Glycoside
GD118020
Name:
3-(4-hydroxyphenyl)-1-(3,4,6-trihydroxy-2-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)prop-2-en-1-oneFormula:
C21H22O11Smiles:
O=C(C=Cc1ccc(O)cc1)c1c(O)cc(O)c(O)c1OC1OC(CO)C(O)C(O)C1OAglycone:
O=C(C=Cc1ccc(O)cc1)c1c(O)cc(O)c(O)c1OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 8 | FractionCSP3: | 0.29 |
| AlogP: | -0.42 | Num_rotatable_bonds: | 6 |
| MolWt: | 450.4 | Num_heavy_atoms: | 32 |
| TPSA: | 197.37 | NumAromaticRings: | 2 |
Unique Aglycone
AD47132
Formula: C15H12O6
Smiles:
O=C(C=Cc1ccc(O)cc1)c1c(O)cc(O)c(O)c1O| HBA: | 6 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.0 |
| AlogP: | 2.11 | Num_rotatable_bonds: | 3 |
| MolWt: | 288.25 | Num_heavy_atoms: | 21 |
| TPSA: | 118.22 | NumAromaticRings: | 2 |
