Glycoside
GD156751
Name:
NoneFormula:
C40H70O16Smiles:
COC1C(OC2C(OCC(CCC(C)C3C(O)C(O)C4C3(C)CCC3C5(C)CCC(O)C(O)C5C(O)CC34O)C(C)C)OC(C(O)CO)C2O)OCC(O)C1OAglycone:
CC(C)C(CO)CCC(C)C1C(O)C(O)C2C1(C)CCC1C3(C)CCC(O)C(O)C3C(O)CC12OSugarmoiety:
COC1C(OC2C(O)OC(C(O)CO)C2O)OCC(O)C1OOther Identifiers
Properties
| HBA: | 16 | RingCount: | 6 |
| HBD: | 11 | FractionCSP3: | 1.0 |
| AlogP: | -1.37 | Num_rotatable_bonds: | 13 |
| MolWt: | 806.98 | Num_heavy_atoms: | 56 |
| TPSA: | 268.68 | NumAromaticRings: | 0 |
Unique Aglycone
AD48572
Formula: C28H50O7
Smiles:
CC(C)C(CO)CCC(C)C1C(O)C(O)C2C1(C)CCC1C3(C)CCC(O)C(O)C3C(O)CC12O| HBA: | 7 | RingCount: | 4 |
| HBD: | 7 | FractionCSP3: | 1.0 |
| AlogP: | 1.69 | Num_rotatable_bonds: | 6 |
| MolWt: | 498.7 | Num_heavy_atoms: | 35 |
| TPSA: | 141.61 | NumAromaticRings: | 0 |
