Glycoside
GD032749
Name:
NoneFormula:
C38H58O11Smiles:
CC(=O)O[C@H]([C@@H]1C[C@H](C)C2=C(O1)[C@H](O)[C@]1(C)C3=CC[C@@H]4C(C)(C)[C@H](O[C@@H]5O[C@H](CO)[C@H](O)[C@H](O)[C@H]5O)CC[C@]45C[C@]35CC[C@]21C)C(C)(C)OAglycone:
CC(=O)OC(C1CC(C)C2=C(O1)C(O)C1(C)C3=CCC4C(C)(C)C(O)CCC45CC35CCC21C)C(C)(C)OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 7 |
| HBD: | 6 | FractionCSP3: | 0.87 |
| AlogP: | 2.88 | Num_rotatable_bonds: | 6 |
| MolWt: | 690.87 | Num_heavy_atoms: | 49 |
| TPSA: | 175.37 | NumAromaticRings: | 0 |
Unique Aglycone
AD20962
Formula: C32H48O6
Smiles:
CC(=O)OC(C1CC(C)C2=C(O1)C(O)C1(C)C3=CCC4C(C)(C)C(O)CCC45CC35CCC21C)C(C)(C)O| HBA: | 6 | RingCount: | 6 |
| HBD: | 3 | FractionCSP3: | 0.84 |
| AlogP: | 5.05 | Num_rotatable_bonds: | 3 |
| MolWt: | 528.73 | Num_heavy_atoms: | 38 |
| TPSA: | 96.22 | NumAromaticRings: | 0 |
