Glycoside
GD120053
Name:
Colletobredin DFormula:
C22H31O8ClSmiles:
CCCCCC1Cc2c(Cl)c(OC3OC(CO)C(O)C(O)C3O)c(C)c(O)c2CO1Aglycone:
CCCCCC1Cc2c(Cl)c(O)c(C)c(O)c2CO1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.71 |
| AlogP: | 1.55 | Num_rotatable_bonds: | 7 |
| MolWt: | 446.92 | Num_heavy_atoms: | 30 |
| TPSA: | 128.84 | NumAromaticRings: | 1 |
Unique Aglycone
AD48182
Formula: C16H21O3Cl
Smiles:
CCCCCC1Cc2c(Cl)c(O)c(C)c(O)c2CO1| HBA: | 3 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.6 |
| AlogP: | 4.08 | Num_rotatable_bonds: | 4 |
| MolWt: | 284.78 | Num_heavy_atoms: | 19 |
| TPSA: | 49.69 | NumAromaticRings: | 1 |
