Drug General Information
Drug ID
D02XEX
Former ID
DNC010341
Drug Name
3-acetyl-11-keto-beta-boswellic acid
Drug Type
Small molecular drug
Indication Discovery agent Investigative [530656]
Structure
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2D MOL

3D MOL

Formula
C32H48O5
Canonical SMILES
CC1CCC2(CCC3(C(=CC(=O)C4C3(CCC5C4(CCC(C5(C)C(=O)O)OC(=O<br />)C)C)C)C2C1C)C)C
InChI
1S/C32H48O5/c1-18-9-12-28(4)15-16-30(6)21(25(28)19(18)2)17-22(34)26-29(5)13-11-24(37-20(3)33)32(8,27(35)36)23(29)10-14-31(26,30)7/h17-19,23-26H,9-16H2,1-8H3,(H,35,36)/t18-,19+,23-,24-,25+,26-,28-,29+,30-,31-,32-/m1/s1
InChIKey
HMMGKOVEOFBCAU-BCDBGHSCSA-N
PubChem Compound ID
Target and Pathway
Target(s) Corticosteroid 11-beta-dehydrogenase, isozyme 2 Target Info Inhibitor [530656]
Corticosteroid 11-beta-dehydrogenase, isozyme 1 Target Info Inhibitor [530656]
KEGG Pathway Steroid hormone biosynthesis
Aldosterone-regulated sodium reabsorptionhsa00140:Steroid hormone biosynthesis
Metabolism of xenobiotics by cytochrome P450
Metabolic pathways
Chemical carcinogenesis
NetPath Pathway EGFR1 Signaling PathwayNetPath_13:IL1 Signaling Pathway
FSH Signaling Pathway
PathWhiz Pathway SteroidogenesisPW000141:Steroidogenesis
Reactome Glucocorticoid biosynthesisR-HSA-194002:Glucocorticoid biosynthesis
WikiPathways Prostaglandin Synthesis and Regulation
Glucocorticoid & Mineralcorticoid MetabolismWP98:Prostaglandin Synthesis and Regulation
Metabolism of steroid hormones and vitamin D
Glucocorticoid & Mineralcorticoid Metabolism
References
Ref 530656Bioorg Med Chem. 2010 Feb 15;18(4):1507-15. Epub 2010 Jan 11.11beta-Hydroxysteroid dehydrogenase 1 inhibiting constituents from Eriobotrya japonica revealed by bioactivity-guided isolation and computational approaches.
Ref 530656Bioorg Med Chem. 2010 Feb 15;18(4):1507-15. Epub 2010 Jan 11.11beta-Hydroxysteroid dehydrogenase 1 inhibiting constituents from Eriobotrya japonica revealed by bioactivity-guided isolation and computational approaches.

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