Glycoside
GD140882
Name:
2-({4a,5-dihydroxy-4,7-dimethyl-1H,4aH,5H,6H,7H,7aH-cyclopenta[c]pyran-1-yl}oxy)-6-(hydroxymethyl)oxane-3,4,5-triolFormula:
C16H26O9Smiles:
CC1=COC(OC2OC(CO)C(O)C(O)C2O)C2C(C)CC(O)C12OAglycone:
CC1=COC(O)C2C(C)CC(O)C12OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.88 |
| AlogP: | -2.19 | Num_rotatable_bonds: | 3 |
| MolWt: | 362.38 | Num_heavy_atoms: | 25 |
| TPSA: | 149.07 | NumAromaticRings: | 0 |
Unique Aglycone
AD56795
Formula: C10H16O4
Smiles:
CC1=COC(O)C2C(C)CC(O)C12O| HBA: | 4 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.8 |
| AlogP: | -0.01 | Num_rotatable_bonds: | 0 |
| MolWt: | 200.23 | Num_heavy_atoms: | 14 |
| TPSA: | 69.92 | NumAromaticRings: | 0 |
