Glycoside
GD028421
Name:
NoneFormula:
C32H48O10Smiles:
CO[C@H]1[C@H](C)O[C@@H](O[C@@H]2CC[C@]3(C)C4C[C@H](O)[C@]5(C)[C@H](C6=CC(=O)OC6)[C@H](OC(C)=O)C[C@@]5(O)C4CC[C@H]3C2)C[C@H]1OAglycone:
CC(=O)OC1CC2(O)C3CCC4CC(O)CCC4(C)C3CC(O)C2(C)C1C1=CC(=O)OC1Sugarmoiety:
COC1C(O)CC(O)OC1COther Identifiers
Properties
| HBA: | 10 | RingCount: | 6 |
| HBD: | 3 | FractionCSP3: | 0.88 |
| AlogP: | 2.65 | Num_rotatable_bonds: | 5 |
| MolWt: | 592.73 | Num_heavy_atoms: | 42 |
| TPSA: | 140.98 | NumAromaticRings: | 0 |
Unique Aglycone
AD18567
Formula: C25H36O7
Smiles:
CC(=O)OC1CC2(O)C3CCC4CC(O)CCC4(C)C3CC(O)C2(C)C1C1=CC(=O)OC1| HBA: | 7 | RingCount: | 5 |
| HBD: | 3 | FractionCSP3: | 0.84 |
| AlogP: | 2.12 | Num_rotatable_bonds: | 2 |
| MolWt: | 448.56 | Num_heavy_atoms: | 32 |
| TPSA: | 113.29 | NumAromaticRings: | 0 |
