Brief Information of the Compound and Protein
Compound Name
MLS001335996
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PubChem ID
CID: 16129778
SID: 14890893
Canonical SMILES
Oc1cc(cc(O)c1O)C(=O)Oc1cc(cc(O)c1O)C(=O)OC[C@H]1O[C@@H](OC(=O)c2cc(O)c(O)c(OC(=O)c3cc(O)c(O)c(O)c3)c2)[C@H](OC(=O)c2cc(O)c(O)c(OC(=O)c3cc(O)c(O)c(O)c3)c2)[C@@H](OC(=O)c2cc(O)c(O)c(OC(=O)c3cc(O)c(O)c(O)c3)c2)[C@@H]1OC(=O)c1cc(O)c(O)c(OC(=O)c2cc(O)c(O)c(O)c2)c1
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Compound Formula C76H52O46
Compound Structure
Protein Name
Cytochrome P450 2C9
Protein Classification
Enzyme
>
Cytochrome P450
>
Cytochrome P450 family 2
>
Cytochrome P450 family 2C
>
Cytochrome P450 2C9
Uniprot ID
P11712
Gene Name
CYP2C9
Table of Molecular Bioactivities Related to the Compound and Protein
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000023 BTI-Tn-5B1-4 Trichoplusia ni (Cabbage looper)  1
1
IC50 = 4607.4 nM
   TI
   LI
   LO
   TS