Glycoside
GD155594
Name:
(1-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1H,4aH,5H,6H-cyclopenta[c]pyran-7-yl)methyl acetateFormula:
C17H24O9Smiles:
CC(=O)OCC1=C2C(C=COC2OC2OC(CO)C(O)C(O)C2O)CC1Aglycone:
CC(=O)OCC1=C2C(C=COC2O)CC1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.71 |
| AlogP: | -1.06 | Num_rotatable_bonds: | 5 |
| MolWt: | 372.37 | Num_heavy_atoms: | 26 |
| TPSA: | 134.91 | NumAromaticRings: | 0 |
Unique Aglycone
AD61708
Formula: C11H14O4
Smiles:
CC(=O)OCC1=C2C(C=COC2O)CC1| HBA: | 4 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.55 |
| AlogP: | 1.12 | Num_rotatable_bonds: | 2 |
| MolWt: | 210.23 | Num_heavy_atoms: | 15 |
| TPSA: | 55.76 | NumAromaticRings: | 0 |
