1-O-DEACETYL-1-O-BENZOYLOHCHINOLIDE B
FEATURES
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NAMES
  • 1-O-Deacetyl-1-O-Benzoylohchinolide B
SMILES
C/C=C(\C)C(=O)O[C@@H]1[C@@H]2OC[C@]3(C)[C@H](OC(C)=O)C[C@H](OC(=O)c4ccccc4)[C@](C)([C@H]4CC(=O)O[C@H]5C[C@@H](c6ccoc6)C(C)=C5[C@]14C)[C@@H]23
InChI
InChI=1S/C40H46O10/c1-8-21(2)36(43)50-35-33-34-38(5,20-46-33)29(47-23(4)41)18-30(49-37(44)24-12-10-9-11-13-24)39(34,6)28-17-31(42)48-27-16-26(25-14-15-45-19-25)22(3)32(27)40(28,35)7/h8-15,19,26-30,33-35H,16-18,20H2,1-7H3/b21-8+/t26-,27+,28-,29-,30+,33-,34+,35-,38-,39+,40-/m1/s1
MOLECULAR FORMULA
C40H46O10
CROSS REFERENCES
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1-O-DEACETYL-1-O-BENZOYLOHCHINOLIDE B
Compound Synopsis
OVERVIEW
PROPERTIES
Molecular weight686.31
AlogP6.50
HBond donors0
HBond acceptors10
Atoms96
Contains toxicophoreYes
Contains PAINSNo
Commercially availableUnknown
Property color indications are based on Lipinski's Ro5.
PROTEIN TARGETS
No information about proteins targeted by 1-O-DEACETYL-1-O-BENZOYLOHCHINOLIDE B.