Glycoside
GD015795
Name:
NoneFormula:
C33H46O10Smiles:
CC(=O)O[C@H]1[C@H](OC(C)=O)[C@H](C)O[C@H](OCC=C2CC[C@@H]3[C@@H]4CCC5=CC(=O)CC[C@@]5(C)[C@H]4[C@H](O)C[C@]23C)[C@@H]1OC(C)=OAglycone:
CC12CC(O)C3C(CCC4=CC(=O)CCC43C)C1CCC2=CCOSugarmoiety:
CC(=O)OC1C(C)OC(O)C(OC(C)=O)C1OC(C)=OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 5 |
| HBD: | 1 | FractionCSP3: | 0.76 |
| AlogP: | 3.97 | Num_rotatable_bonds: | 6 |
| MolWt: | 602.72 | Num_heavy_atoms: | 43 |
| TPSA: | 134.66 | NumAromaticRings: | 0 |
Unique Aglycone
AD07460
Formula: C21H30O3
Smiles:
CC12CC(O)C3C(CCC4=CC(=O)CCC43C)C1CCC2=CCO| HBA: | 3 | RingCount: | 4 |
| HBD: | 2 | FractionCSP3: | 0.76 |
| AlogP: | 3.41 | Num_rotatable_bonds: | 1 |
| MolWt: | 330.47 | Num_heavy_atoms: | 24 |
| TPSA: | 57.53 | NumAromaticRings: | 0 |
