Glycoside
GD121109
Name:
3-[3,7-dimethoxy-2-(3-methoxy-4-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)-2,3-dihydro-1-benzofuran-5-yl]prop-2-enalFormula:
C26H30O11Smiles:
COc1cc(C2Oc3c(OC)cc(C=CC=O)cc3C2OC)ccc1OC1OC(CO)C(O)C(O)C1OAglycone:
COc1cc(C2Oc3c(OC)cc(C=CC=O)cc3C2OC)ccc1OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.42 |
| AlogP: | 0.92 | Num_rotatable_bonds: | 9 |
| MolWt: | 518.52 | Num_heavy_atoms: | 37 |
| TPSA: | 153.37 | NumAromaticRings: | 2 |
Unique Aglycone
AD48718
Formula: C20H20O6
Smiles:
COc1cc(C2Oc3c(OC)cc(C=CC=O)cc3C2OC)ccc1O| HBA: | 6 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.25 |
| AlogP: | 3.44 | Num_rotatable_bonds: | 6 |
| MolWt: | 356.37 | Num_heavy_atoms: | 26 |
| TPSA: | 74.22 | NumAromaticRings: | 2 |
