Glycoside
GD147605
Name:
2-{4-[4-(7-hydroxy-2H-1,3-benzodioxol-5-yl)-hexahydrofuro[3,4-c]furan-1-yl]-2-methoxyphenoxy}-6-(hydroxymethyl)oxane-3,4,5-triolFormula:
C26H30O12Smiles:
COc1cc(C2OCC3C(c4cc(O)c5c(c4)OCO5)OCC23)ccc1OC1OC(CO)C(O)C(O)C1OAglycone:
COc1cc(C2OCC3C(c4cc(O)c5c(c4)OCO5)OCC23)ccc1OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 6 |
| HBD: | 5 | FractionCSP3: | 0.54 |
| AlogP: | 0.38 | Num_rotatable_bonds: | 6 |
| MolWt: | 534.51 | Num_heavy_atoms: | 38 |
| TPSA: | 165.76 | NumAromaticRings: | 2 |
Unique Aglycone
AD59100
Formula: C20H20O7
Smiles:
COc1cc(C2OCC3C(c4cc(O)c5c(c4)OCO5)OCC23)ccc1O| HBA: | 7 | RingCount: | 5 |
| HBD: | 2 | FractionCSP3: | 0.4 |
| AlogP: | 2.91 | Num_rotatable_bonds: | 3 |
| MolWt: | 372.37 | Num_heavy_atoms: | 27 |
| TPSA: | 86.61 | NumAromaticRings: | 2 |
