Glycoside
GD135907
Name:
(5-hydroxy-1-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1H,4aH,5H,7aH-cyclopenta[c]pyran-7-yl)methyl 3,4-dimethoxybenzoateFormula:
C24H30O12Smiles:
COc1ccc(C(=O)OCC2=CC(O)C3C=COC(OC4OC(CO)C(O)C(O)C4O)C23)cc1OCAglycone:
COc1ccc(C(=O)OCC2=CC(O)C3C=COC(O)C23)cc1OCSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.54 |
| AlogP: | -0.92 | Num_rotatable_bonds: | 8 |
| MolWt: | 510.49 | Num_heavy_atoms: | 36 |
| TPSA: | 173.6 | NumAromaticRings: | 1 |
Unique Aglycone
AD54942
Formula: C18H20O7
Smiles:
COc1ccc(C(=O)OCC2=CC(O)C3C=COC(O)C23)cc1OC| HBA: | 7 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.39 |
| AlogP: | 1.26 | Num_rotatable_bonds: | 5 |
| MolWt: | 348.35 | Num_heavy_atoms: | 25 |
| TPSA: | 94.45 | NumAromaticRings: | 1 |
