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Chapecoderin B
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NAMES
  • Chapecoderin B
SMILES
CC(=O)[C@@H]1C[C@H]2C(C)(C)CCC[C@]2(C)[C@@]1(O)CCC1=CCOC1=O
InChI
InChI=1S/C20H30O4/c1-13(21)15-12-16-18(2,3)8-5-9-19(16,4)20(15,23)10-6-14-7-11-24-17(14)22/h7,15-16,23H,5-6,8-12H2,1-4H3/t15-,16-,19-,20+/m0/s1
MOLECULAR FORMULA
C20H30O4
CROSS REFERENCES
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Chapecoderin B

Compound Synopsis

OVERVIEW
PROPERTIES
Molecular weight 334.21
AlogP 3.42
HBond donors 1
HBond acceptors 4
Atoms 54
Contains toxicophore No
Contains PAINS No
Commercially available Unknown
Property color indications are based on Lipinski's Ro5.
PROTEIN TARGETS
No information about proteins targeted by Chapecoderin B.