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Alisiaquinol
FEATURES
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NAMES
  • Alisiaquinol
SMILES
C[C@@]12CCC[C@]3(C)c4cc5c(O)ccc(O)c5cc4C(=O)[C@](O)(OC1)[C@H]23
InChI
InChI=1S/C21H22O5/c1-19-6-3-7-20(2)14-9-12-11(15(22)4-5-16(12)23)8-13(14)17(24)21(25,18(19)20)26-10-19/h4-5,8-9,18,22-23,25H,3,6-7,10H2,1-2H3/t18-,19-,20-,21+/m1/s1
MOLECULAR FORMULA
C21H22O5
CROSS REFERENCES
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Alisiaquinol

Compound Synopsis

OVERVIEW
PROPERTIES
Molecular weight 354.15
AlogP 3.23
HBond donors 3
HBond acceptors 5
Atoms 48
Contains toxicophore Yes
Contains PAINS No
Commercially available Unknown
Property color indications are based on Lipinski's Ro5.
PROTEIN TARGETS
No information about proteins targeted by Alisiaquinol.