Glycoside
GD005875
Name:
NoneFormula:
C20H30O11Smiles:
C[C@@H]1[C@H](O[C@@H]2O[C@H](C(=O)O)C(O)[C@H](O)C2O)O[C@@H]2O[C@@H]3CC[C@@H]4[C@H](C)CC[C@H]1[C@]24OO3Aglycone:
CC1CCC2C(C)C(O)OC3OC4CCC1C32OO4Sugarmoiety:
O=C(O)C1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 6 |
| HBD: | 4 | FractionCSP3: | 0.95 |
| AlogP: | -0.29 | Num_rotatable_bonds: | 3 |
| MolWt: | 446.45 | Num_heavy_atoms: | 31 |
| TPSA: | 153.37 | NumAromaticRings: | 0 |
Unique Aglycone
AD04923
Formula: C14H22O5
Smiles:
CC1CCC2C(C)C(O)OC3OC4CCC1C32OO4| HBA: | 5 | RingCount: | 5 |
| HBD: | 1 | FractionCSP3: | 1.0 |
| AlogP: | 1.8 | Num_rotatable_bonds: | 0 |
| MolWt: | 270.32 | Num_heavy_atoms: | 19 |
| TPSA: | 57.15 | NumAromaticRings: | 0 |
