Glycoside
GD123507
Name:
Pestalotin_4'-O-Methyl-B-MannopyranosideFormula:
C18H30O9Smiles:
CCCCC(OC1OC(CO)C(OC)C(O)C1O)C1CC(OC)=CC(=O)O1Aglycone:
CCCCC(O)C1CC(OC)=CC(=O)O1Sugarmoiety:
COC1C(CO)OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.83 |
| AlogP: | -0.14 | Num_rotatable_bonds: | 9 |
| MolWt: | 390.43 | Num_heavy_atoms: | 27 |
| TPSA: | 123.91 | NumAromaticRings: | 0 |
Unique Aglycone
AD49851
Formula: C11H18O4
Smiles:
CCCCC(O)C1CC(OC)=CC(=O)O1| HBA: | 4 | RingCount: | 1 |
| HBD: | 1 | FractionCSP3: | 0.73 |
| AlogP: | 1.38 | Num_rotatable_bonds: | 5 |
| MolWt: | 214.26 | Num_heavy_atoms: | 15 |
| TPSA: | 55.76 | NumAromaticRings: | 0 |
