Glycoside
GD093126
Name:
NoneFormula:
C22H32O9Smiles:
COc1cc([C@H]2C[C@@H](O[C@@H]3O[C@@H](C)[C@H](O)[C@@H](O)[C@H]3O)[C@@H]3CCC[C@H]3O2)cc(OC)c1OAglycone:
COc1cc(C2CC(O)C3CCCC3O2)cc(OC)c1OSugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.73 |
| AlogP: | 1.25 | Num_rotatable_bonds: | 5 |
| MolWt: | 440.49 | Num_heavy_atoms: | 31 |
| TPSA: | 127.07 | NumAromaticRings: | 1 |
Unique Aglycone
AD40389
Formula: C16H22O5
Smiles:
COc1cc(C2CC(O)C3CCCC3O2)cc(OC)c1O| HBA: | 5 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.62 |
| AlogP: | 2.4 | Num_rotatable_bonds: | 3 |
| MolWt: | 294.35 | Num_heavy_atoms: | 21 |
| TPSA: | 68.15 | NumAromaticRings: | 1 |
