Glycoside
GD145868
Name:
(4-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)methyl 1,6-dihydroxy-7-methyl-1H,4aH,5H,6H,7H,7aH-cyclopenta[c]pyran-4-carboxylateFormula:
C23H30O11Smiles:
CC1C(O)CC2C(C(=O)OCc3ccc(OC4OC(CO)C(O)C(O)C4O)cc3)=COC(O)C21Aglycone:
CC1C(O)CC2C(C(=O)OCc3ccc(O)cc3)=COC(O)C21Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 4 |
| HBD: | 6 | FractionCSP3: | 0.61 |
| AlogP: | -1.23 | Num_rotatable_bonds: | 6 |
| MolWt: | 482.48 | Num_heavy_atoms: | 34 |
| TPSA: | 175.37 | NumAromaticRings: | 1 |
Unique Aglycone
AD58523
Formula: C17H20O6
Smiles:
CC1C(O)CC2C(C(=O)OCc3ccc(O)cc3)=COC(O)C21| HBA: | 6 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.47 |
| AlogP: | 1.3 | Num_rotatable_bonds: | 3 |
| MolWt: | 320.34 | Num_heavy_atoms: | 23 |
| TPSA: | 96.22 | NumAromaticRings: | 1 |
