Glycoside
GD141068
Name:
5,7-dihydroxy-1-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1H,4aH,5H,6H,7H,7aH-cyclopenta[c]pyran-4-carboxylic acidFormula:
C15H22O11Smiles:
O=C(O)C1=COC(OC2OC(CO)C(O)C(O)C2O)C2C(O)CC(O)C12Aglycone:
O=C(O)C1=COC(O)C2C(O)CC(O)C12Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 7 | FractionCSP3: | 0.8 |
| AlogP: | -3.51 | Num_rotatable_bonds: | 4 |
| MolWt: | 378.33 | Num_heavy_atoms: | 26 |
| TPSA: | 186.37 | NumAromaticRings: | 0 |
Unique Aglycone
AD56860
Formula: C9H12O6
Smiles:
O=C(O)C1=COC(O)C2C(O)CC(O)C12| HBA: | 6 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.67 |
| AlogP: | -1.34 | Num_rotatable_bonds: | 1 |
| MolWt: | 216.19 | Num_heavy_atoms: | 15 |
| TPSA: | 107.22 | NumAromaticRings: | 0 |
