APE1/Ref-1 Redox Inhibitor APX3330
(2E)-2-[(4,5-dimethoxy-2-methyl-3,6-dioxocyclohexa-1,4-dien-1-yl)methylidene]undecanoic acid
Molecular Identity
APE1/Ref-1 Redox Inhibitor APX3330
(2E)-2-[(4,5-dimethoxy-2-methyl-3,6-dioxocyclohexa-1,4-dien-1-yl)methylidene]undecanoic acid
PubChem CID: 6439397
2D Structure
Properties
C21H30O6
Molecular Formula
378.50
Molecular Weight
g/mol
378.2042
Exact Mass
Da
5.3
XLogP
Above Lipinski threshold
89.9
TPSA
Good oral absorption (< 140 A²)
1
H-Bond Donors
6
H-Bond Acceptors
666
Complexity
SMILES
Canonical SMILES
SMILES: CCCCCCCCCC(=CC1=C(C(=O)C(=C(C1=O)OC)OC)C)C(=O)OIsomeric SMILES
SMILES: CCCCCCCCC/C(=C\C1=C(C(=O)C(=C(C1=O)OC)OC)C)/C(=O)OSynonyms(20)
E3330136164-66-4E 3330E-3330APX-3330APX333011267UI968APX 3330(2E)-3-(5-(2,3-Dimethoxy-6-methyl-1,4-benzoquinoyl))-2-nonyl-2-propenoic acidAPE1/REF-1 REDOX INHIBITOR APX3330(2E)-2-[(4,5-Dimethoxy-2-methyl-3,6-dioxo-1,4-cyclohexadien-1-yl)methylene]undecanoic acidUndecanoic acid, 2-((4,5-dimethoxy-2-methyl-3,6-dioxo-1,4-cyclohexadien-1-yl)methylene)-, (E)-((2E)-2-((4,5-dimethoxy-2-methyl-3,6-dioxo-1,4-cyclohexadien-1-yl)methylene)-undecanoic Acid(2E)-2-((4,5-Dimethoxy-2-methyl-3,6-dioxo-1,4-cyclohexadien-1-yl)methylene)undecanoic acid[(2E)-2-[(4,5-dimethoxy-2-methyl-3,6-dioxo-1,4-cyclohexadien-1-yl)methylene]-undecanoic Acid
Data from PubChem (NCBI)
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Drug Network
Trials and conditions connected to APE1/Ref-1 Redox Inhibitor APX3330
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