Glycoside
GD028817
Name:
NoneFormula:
C16H24O8Smiles:
CC1OC(O[C@@H]2OC=C(C=O)[C@]3(O)CC[C@H](C)[C@H]23)C(O)C(O)C1OAglycone:
CC1CCC2(O)C(C=O)=COC(O)C12Sugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.81 |
| AlogP: | -0.95 | Num_rotatable_bonds: | 3 |
| MolWt: | 344.36 | Num_heavy_atoms: | 24 |
| TPSA: | 125.68 | NumAromaticRings: | 0 |
Unique Aglycone
AD18785
Formula: C10H14O4
Smiles:
CC1CCC2(O)C(C=O)=COC(O)C12| HBA: | 4 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.7 |
| AlogP: | 0.19 | Num_rotatable_bonds: | 1 |
| MolWt: | 198.22 | Num_heavy_atoms: | 14 |
| TPSA: | 66.76 | NumAromaticRings: | 0 |
