Glycoside
GD144102
Name:
6-methoxy-8-(3-methylbut-2-en-1-yl)-7-{[3,4,5-trihydroxy-6-({[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}methyl)oxan-2-yl]oxy}-2H-chromen-2-oneFormula:
C27H36O14Smiles:
COc1cc2ccc(=O)oc2c(CC=C(C)C)c1OC1OC(COC2OC(CO)C(O)C(O)C2O)C(O)C(O)C1OAglycone:
COc1cc2ccc(=O)oc2c(CC=C(C)C)c1OSugarmoiety:
OCC1OC(OCC2OC(O)C(O)C(O)C2O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 14 | RingCount: | 4 |
| HBD: | 7 | FractionCSP3: | 0.59 |
| AlogP: | -1.69 | Num_rotatable_bonds: | 9 |
| MolWt: | 584.57 | Num_heavy_atoms: | 41 |
| TPSA: | 217.97 | NumAromaticRings: | 2 |
Unique Aglycone
AD57928
Formula: C15H16O4
Smiles:
COc1cc2ccc(=O)oc2c(CC=C(C)C)c1O| HBA: | 4 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.27 |
| AlogP: | 3.02 | Num_rotatable_bonds: | 3 |
| MolWt: | 260.29 | Num_heavy_atoms: | 19 |
| TPSA: | 59.67 | NumAromaticRings: | 2 |
