Glycoside
GD014123
Name:
NoneFormula:
C20H28O7Smiles:
COc1ccc(C2(C(=O)O)CCCCC2)cc1[C@@H]1O[C@H](C)[C@H](O)[C@H](O)[C@H]1OAglycone:
COc1ccc(C2(C(=O)O)CCCCC2)cc1Sugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.65 |
| AlogP: | 1.52 | Num_rotatable_bonds: | 4 |
| MolWt: | 380.44 | Num_heavy_atoms: | 27 |
| TPSA: | 116.45 | NumAromaticRings: | 1 |
Unique Aglycone
AD08821
Formula: C14H18O3
Smiles:
COc1ccc(C2(C(=O)O)CCCCC2)cc1| HBA: | 3 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.5 |
| AlogP: | 2.98 | Num_rotatable_bonds: | 3 |
| MolWt: | 234.29 | Num_heavy_atoms: | 17 |
| TPSA: | 46.53 | NumAromaticRings: | 1 |
