Glycoside
GD151553
Name:
methyl 1-{[4,5-dihydroxy-6-(hydroxymethyl)-3-methyloxan-2-yl]oxy}-6-hydroxy-7-methyl-1H,4aH,5H,6H,7H,7aH-cyclopenta[c]pyran-4-carboxylateFormula:
C18H28O9Smiles:
COC(=O)C1=COC(OC2OC(CO)C(O)C(O)C2C)C2C1CC(O)C2CAglycone:
COC(=O)C1=COC(O)C2C1CC(O)C2CSugarmoiety:
CC1C(O)OC(CO)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.83 |
| AlogP: | -0.88 | Num_rotatable_bonds: | 4 |
| MolWt: | 388.41 | Num_heavy_atoms: | 27 |
| TPSA: | 134.91 | NumAromaticRings: | 0 |
Unique Aglycone
AD00333
Formula: C11H16O5
Smiles:
COC(=O)C1=COC(O)C2C1CC(O)C2C| HBA: | 5 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.73 |
| AlogP: | 0.02 | Num_rotatable_bonds: | 1 |
| MolWt: | 228.24 | Num_heavy_atoms: | 16 |
| TPSA: | 75.99 | NumAromaticRings: | 0 |
