Glycoside
GD016130
Name:
NoneFormula:
C33H58O7Smiles:
CC(C)CCC[C@H](C)[C@@H]1CC[C@@H]2[C@@H]3CC[C@@H]4C[C@H](O[C@@H]5O[C@H](CO)[C@H](O)[C@H](O)[C@H]5O)[C@H](O)C[C@@]4(C)[C@H]3CC[C@@]12CAglycone:
CC(C)CCCC(C)C1CCC2C3CCC4CC(O)C(O)CC4(C)C3CCC12CSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 5 |
| HBD: | 5 | FractionCSP3: | 1.0 |
| AlogP: | 4.26 | Num_rotatable_bonds: | 8 |
| MolWt: | 566.82 | Num_heavy_atoms: | 40 |
| TPSA: | 119.61 | NumAromaticRings: | 0 |
Unique Aglycone
AD01514
Formula: C27H48O2
Smiles:
CC(C)CCCC(C)C1CCC2C3CCC4CC(O)C(O)CC4(C)C3CCC12C| HBA: | 2 | RingCount: | 4 |
| HBD: | 2 | FractionCSP3: | 1.0 |
| AlogP: | 6.44 | Num_rotatable_bonds: | 5 |
| MolWt: | 404.68 | Num_heavy_atoms: | 29 |
| TPSA: | 40.46 | NumAromaticRings: | 0 |
