Glycoside
GD027682
Name:
NoneFormula:
C38H52O17Smiles:
CC=C(C)C(=O)O[C@@H]1C[C@H](OC(C)=O)[C@]2(C(=O)OC)CO[C@@H]3[C@H]2[C@]12CO[C@](OC)(C(=O)OC)[C@H]2[C@]1(C)[C@]32O[C@@H]3C[C@H]([C@]4(OC)CCO[C@H]4OC)[C@](C)(O2)[C@]31OAglycone:
CC=C(C)C(=O)OC1CC(OC(C)=O)C2(C(=O)OC)COC3C2C12COC(OC)(C(=O)OC)C2C1(C)C32OC3CCC(C)(O2)C31OSugarmoiety:
COC1OCCC1(O)OCOther Identifiers
Properties
| HBA: | 17 | RingCount: | 8 |
| HBD: | 1 | FractionCSP3: | 0.84 |
| AlogP: | 0.96 | Num_rotatable_bonds: | 9 |
| MolWt: | 780.82 | Num_heavy_atoms: | 55 |
| TPSA: | 199.27 | NumAromaticRings: | 0 |
Unique Aglycone
AD18163
Formula: C32H42O14
Smiles:
CC=C(C)C(=O)OC1CC(OC(C)=O)C2(C(=O)OC)COC3C2C12COC(OC)(C(=O)OC)C2C1(C)C32OC3CCC(C)(O2)C31O| HBA: | 14 | RingCount: | 7 |
| HBD: | 1 | FractionCSP3: | 0.81 |
| AlogP: | 0.95 | Num_rotatable_bonds: | 6 |
| MolWt: | 650.67 | Num_heavy_atoms: | 46 |
| TPSA: | 171.58 | NumAromaticRings: | 0 |
