Glycoside
GD034219
Name:
NoneFormula:
C35H58O7Smiles:
CC1(C)CC[C@]2(CO)CC[C@]3(C)C(=CC[C@@H]4[C@]5(C)CC[C@@H]6O[C@H]([C@H](O)[C@H](O)[C@H](O)CO)OC[C@@]6(C)[C@H]5CC[C@]43C)[C@H]2C1Aglycone:
CC1(C)CCC2(CO)CCC3(C)C(=CCC4C5(C)CCC6OCOCC6(C)C5CCC43C)C2C1Sugarmoiety:
OCC(O)C(O)C(O)OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 6 |
| HBD: | 5 | FractionCSP3: | 0.94 |
| AlogP: | 4.58 | Num_rotatable_bonds: | 5 |
| MolWt: | 590.84 | Num_heavy_atoms: | 42 |
| TPSA: | 119.61 | NumAromaticRings: | 0 |
Unique Aglycone
AD17729
Formula: C31H50O3
Smiles:
CC1(C)CCC2(CO)CCC3(C)C(=CCC4C5(C)CCC6OCOCC6(C)C5CCC43C)C2C1| HBA: | 3 | RingCount: | 6 |
| HBD: | 1 | FractionCSP3: | 0.94 |
| AlogP: | 7.13 | Num_rotatable_bonds: | 1 |
| MolWt: | 470.74 | Num_heavy_atoms: | 34 |
| TPSA: | 38.69 | NumAromaticRings: | 0 |
