Glycoside
GD019106
Name:
MOUDANPIOSIDE FFormula:
C16H24O8Smiles:
CC1=CC(=O)[C@@H]2C[C@@]1(O[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O)[C@@]2(C)COAglycone:
CC1=CC(=O)C2CC1(O)C2(C)COSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.81 |
| AlogP: | -1.91 | Num_rotatable_bonds: | 4 |
| MolWt: | 344.36 | Num_heavy_atoms: | 24 |
| TPSA: | 136.68 | NumAromaticRings: | 0 |
Unique Aglycone
AD13214
Formula: C10H14O3
Smiles:
CC1=CC(=O)C2CC1(O)C2(C)CO| HBA: | 3 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.7 |
| AlogP: | 0.26 | Num_rotatable_bonds: | 1 |
| MolWt: | 182.22 | Num_heavy_atoms: | 13 |
| TPSA: | 57.53 | NumAromaticRings: | 0 |
