Glycoside
GD030228
Name:
NoneFormula:
C22H28O10Smiles:
CC=CCCc1cc2cc(O[C@@H]3O[C@H](CO)[C@H](OC)[C@H](O)[C@H]3O)c(OC)c(O)c2c(=O)o1Aglycone:
CC=CCCc1cc2cc(O)c(OC)c(O)c2c(=O)o1Sugarmoiety:
COC1C(CO)OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.5 |
| AlogP: | 0.85 | Num_rotatable_bonds: | 8 |
| MolWt: | 452.46 | Num_heavy_atoms: | 32 |
| TPSA: | 148.05 | NumAromaticRings: | 2 |
Unique Aglycone
AD19571
Formula: C15H16O5
Smiles:
CC=CCCc1cc2cc(O)c(OC)c(O)c2c(=O)o1| HBA: | 5 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.27 |
| AlogP: | 2.72 | Num_rotatable_bonds: | 4 |
| MolWt: | 276.29 | Num_heavy_atoms: | 20 |
| TPSA: | 79.9 | NumAromaticRings: | 2 |
