Glycoside
GD022486
Name:
NoneFormula:
C33H54O9Smiles:
CO[C@H]1[C@H](O)[C@@H](O[C@@H]2CC3=C4[C@H](O)[C@H](O)[C@@H]5C[C@H](O)CC[C@@]5(C)[C@H]4CC[C@@]3(C)[C@H]2[C@H](C)C=CC(C)C)O[C@@H](CO)[C@H]1OAglycone:
CC(C)C=CC(C)C1C(O)CC2=C3C(O)C(O)C4CC(O)CCC4(C)C3CCC21CSugarmoiety:
COC1C(O)C(O)OC(CO)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 5 |
| HBD: | 6 | FractionCSP3: | 0.88 |
| AlogP: | 2.31 | Num_rotatable_bonds: | 7 |
| MolWt: | 594.79 | Num_heavy_atoms: | 42 |
| TPSA: | 149.07 | NumAromaticRings: | 0 |
Unique Aglycone
AD15235
Formula: C26H42O4
Smiles:
CC(C)C=CC(C)C1C(O)CC2=C3C(O)C(O)C4CC(O)CCC4(C)C3CCC21C| HBA: | 4 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.85 |
| AlogP: | 3.83 | Num_rotatable_bonds: | 3 |
| MolWt: | 418.62 | Num_heavy_atoms: | 30 |
| TPSA: | 80.92 | NumAromaticRings: | 0 |
