(+)-ACULEATIN B
FEATURES
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NAMES
  • (+)-Aculeatin B
SMILES
CCCCCCCCCCCCC[C@H]1C[C@@H](O)C[C@]2(CCC3(C=CC(=O)C=C3)O2)O1
InChI
InChI=1S/C26H42O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-24-20-23(28)21-26(29-24)19-18-25(30-26)16-14-22(27)15-17-25/h14-17,23-24,28H,2-13,18-21H2,1H3/t23-,24+,26-/m1/s1
MOLECULAR FORMULA
C26H42O4
CROSS REFERENCES
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(+)-ACULEATIN B
Compound Synopsis
OVERVIEW
PROPERTIES
Molecular weight418.31
AlogP6.17
HBond donors1
HBond acceptors4
Atoms72
Contains toxicophoreYes
Contains PAINSNo
Commercially availableUnknown
Property color indications are based on Lipinski's Ro5.
PROTEIN TARGETS
No information about proteins targeted by (+)-ACULEATIN B.