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2-Deacetylchamissonolide
FEATURES
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NAMES
  • 2-Deacetylchamissonolide
SMILES
C=C1C(=O)O[C@@H]2C[C@@H](C)[C@@H]3[C@@H](O)C[C@@H](O)[C@@]3(C)[C@@H](O)[C@H]12
InChI
InChI=1S/C15H22O5/c1-6-4-9-11(7(2)14(19)20-9)13(18)15(3)10(17)5-8(16)12(6)15/h6,8-13,16-18H,2,4-5H2,1,3H3/t6-,8+,9-,10-,11-,12-,13+,15-/m1/s1
MOLECULAR FORMULA
C15H22O5
CROSS REFERENCES
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2-Deacetylchamissonolide

Compound Synopsis

OVERVIEW
PROPERTIES
Molecular weight 282.15
AlogP 0.23
HBond donors 3
HBond acceptors 5
Atoms 42
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 2-Deacetylchamissonolide.