Glycoside
GD011962
Name:
NoneFormula:
C40H68O14Smiles:
CO[C@@]1(CC[C@H](C)CO)O[C@@H]2C[C@@H]3[C@@H]4CCC5C[C@H](O[C@@H]6O[C@H](CO)[C@H](O)[C@H](O)[C@H]6O[C@@H]6O[C@H](C)[C@H](O)[C@H](O)[C@H]6O)CC[C@@]5(C)[C@H]4CC[C@@]3(C)[C@@]2(O)[C@H]1CAglycone:
COC1(CCC(C)CO)OC2CC3C4CCC5CC(O)CCC5(C)C4CCC3(C)C2(O)C1CSugarmoiety:
CC1OC(OC2C(O)OC(CO)C(O)C2O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 14 | RingCount: | 7 |
| HBD: | 8 | FractionCSP3: | 1.0 |
| AlogP: | 1.19 | Num_rotatable_bonds: | 10 |
| MolWt: | 772.97 | Num_heavy_atoms: | 54 |
| TPSA: | 217.22 | NumAromaticRings: | 0 |
Unique Aglycone
AD00143
Formula: C28H48O5
Smiles:
COC1(CCC(C)CO)OC2CC3C4CCC5CC(O)CCC5(C)C4CCC3(C)C2(O)C1C| HBA: | 5 | RingCount: | 5 |
| HBD: | 3 | FractionCSP3: | 1.0 |
| AlogP: | 4.52 | Num_rotatable_bonds: | 5 |
| MolWt: | 464.69 | Num_heavy_atoms: | 33 |
| TPSA: | 79.15 | NumAromaticRings: | 0 |
