Glycoside
GD125494
Name:
3-{2-[(3-{[3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxy}-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl)oxy]-4-hydroxyphenyl}-1-(2,4-dihydroxyphenyl)prop-2-en-1-oneFormula:
C26H30O14Smiles:
O=C(C=Cc1ccc(O)cc1OC1OC(CO)C(O)C(O)C1OC1OCC(O)(CO)C1O)c1ccc(O)cc1OAglycone:
O=C(C=Cc1ccc(O)cc1O)c1ccc(O)cc1OSugarmoiety:
OCC1OC(O)C(OC2OCC(O)(CO)C2O)C(O)C1OOther Identifiers
Properties
| HBA: | 14 | RingCount: | 4 |
| HBD: | 9 | FractionCSP3: | 0.42 |
| AlogP: | -1.66 | Num_rotatable_bonds: | 9 |
| MolWt: | 566.51 | Num_heavy_atoms: | 40 |
| TPSA: | 236.06 | NumAromaticRings: | 2 |
Unique Aglycone
AD50753
Formula: C15H12O5
Smiles:
O=C(C=Cc1ccc(O)cc1O)c1ccc(O)cc1O| HBA: | 5 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.0 |
| AlogP: | 2.41 | Num_rotatable_bonds: | 3 |
| MolWt: | 272.26 | Num_heavy_atoms: | 20 |
| TPSA: | 97.99 | NumAromaticRings: | 2 |
