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CARABRYL 4-METHOXYBENZOATE
FEATURES
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NAMES
  • CARABRYL 4-METHOXYBENZOATE
SMILES
C=C1C(=O)O[C@@H]2C[C@]3(C)C(CCC(C)OC(=O)c4ccc(OC)cc4)[C@@H]3C[C@H]12
InChI
InChI=1S/C23H28O5/c1-13(27-22(25)15-6-8-16(26-4)9-7-15)5-10-18-19-11-17-14(2)21(24)28-20(17)12-23(18,19)3/h6-9,13,17-20H,2,5,10-12H2,1,3-4H3/t13?,17-,18?,19+,20-,23-/m1/s1
MOLECULAR FORMULA
C23H28O5
CROSS REFERENCES
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CARABRYL 4-METHOXYBENZOATE

Compound Synopsis

OVERVIEW
PROPERTIES
Molecular weight 384.19
AlogP 4.16
HBond donors 0
HBond acceptors 5
Atoms 56
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 CARABRYL 4-METHOXYBENZOATE.