Glycoside
GD151793
Name:
FlocculosinFormula:
C40H72O18Smiles:
CCCCCCCCCCCCCCCCC(COC1OC(CO)C(OC2OC(CO)C(O)C(O)C2O)C(O)C1O)OCC(CC(CC(=O)O)OC(C)=O)OC(C)=OAglycone:
CCCCCCCCCCCCCCCCC(CO)OCC(CC(CC(=O)O)OC(C)=O)OC(C)=OSugarmoiety:
OCC1OC(OC2C(CO)OC(O)C(O)C2O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 18 | RingCount: | 2 |
| HBD: | 8 | FractionCSP3: | 0.93 |
| AlogP: | 1.61 | Num_rotatable_bonds: | 31 |
| MolWt: | 841.0 | Num_heavy_atoms: | 58 |
| TPSA: | 277.66 | NumAromaticRings: | 0 |
Unique Aglycone
AD60501
Formula: C28H52O8
Smiles:
CCCCCCCCCCCCCCCCC(CO)OCC(CC(CC(=O)O)OC(C)=O)OC(C)=O| HBA: | 8 | RingCount: | 0 |
| HBD: | 2 | FractionCSP3: | 0.89 |
| AlogP: | 5.96 | Num_rotatable_bonds: | 25 |
| MolWt: | 516.72 | Num_heavy_atoms: | 36 |
| TPSA: | 119.36 | NumAromaticRings: | 0 |
