Glycoside
GD151736
Name:
4-(acetyloxy)-6-{2,3-dihydroxy-4-[3-(4-hydroxyphenyl)prop-2-enoyl]phenoxy}-5-hydroxy-2-(hydroxymethyl)oxan-3-yl acetateFormula:
C25H26O12Smiles:
CC(=O)OC1C(CO)OC(Oc2ccc(C(=O)C=Cc3ccc(O)cc3)c(O)c2O)C(O)C1OC(C)=OAglycone:
O=C(C=Cc1ccc(O)cc1)c1ccc(O)c(O)c1OSugarmoiety:
CC(=O)OC1C(CO)OC(O)C(O)C1OC(C)=OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.32 |
| AlogP: | 1.02 | Num_rotatable_bonds: | 8 |
| MolWt: | 518.47 | Num_heavy_atoms: | 37 |
| TPSA: | 189.28 | NumAromaticRings: | 2 |
Unique Aglycone
AD13415
Formula: C15H12O5
Smiles:
O=C(C=Cc1ccc(O)cc1)c1ccc(O)c(O)c1O| 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 |
