Glycoside
GD147614
Name:
methyl 7-formyl-1-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1H,4aH,5H,7aH-cyclopenta[c]pyran-4-carboxylateFormula:
C17H22O10Smiles:
COC(=O)C1=COC(OC2OC(CO)C(O)C(O)C2O)C2C(C=O)=CCC12Aglycone:
COC(=O)C1=COC(O)C2C(C=O)=CCC12Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.65 |
| AlogP: | -2.02 | Num_rotatable_bonds: | 5 |
| MolWt: | 386.35 | Num_heavy_atoms: | 27 |
| TPSA: | 151.98 | NumAromaticRings: | 0 |
Unique Aglycone
AD59106
Formula: C11H12O5
Smiles:
COC(=O)C1=COC(O)C2C(C=O)=CCC12| HBA: | 5 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.45 |
| AlogP: | 0.15 | Num_rotatable_bonds: | 2 |
| MolWt: | 224.21 | Num_heavy_atoms: | 16 |
| TPSA: | 72.83 | NumAromaticRings: | 0 |
