Glycoside
GD156701
Name:
4a-hydroxy-7-methyl-1-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-octahydrocyclopenta[c]pyran-4-carbaldehydeFormula:
C16H26O9Smiles:
CC1CCC2(O)C(C=O)COC(OC3OC(CO)C(O)C(O)C3O)C12Aglycone:
CC1CCC2(O)C(C=O)COC(O)C12Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.94 |
| AlogP: | -2.25 | Num_rotatable_bonds: | 4 |
| MolWt: | 362.38 | Num_heavy_atoms: | 25 |
| TPSA: | 145.91 | NumAromaticRings: | 0 |
Unique Aglycone
AD62023
Formula: C10H16O4
Smiles:
CC1CCC2(O)C(C=O)COC(O)C12| HBA: | 4 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.9 |
| AlogP: | -0.07 | Num_rotatable_bonds: | 1 |
| MolWt: | 200.23 | Num_heavy_atoms: | 14 |
| TPSA: | 66.76 | NumAromaticRings: | 0 |
