Drug General Information
Drug ID	D0V8SM
Former ID	DNC004465
Drug Name	8-Imidazol-1-ylmethyl-5-nitro-chromen-4-one
Drug Type	Small molecular drug
Indication	Discovery agent		Investigative	[535139]
Structure		Download 2D MOL 3D MOL
Formula	C13H9N3O4
Canonical SMILES	C1=CC(=C2C(=O)C=COC2=C1CN3C=CN=C3)[N+](=O)[O-]
InChI	1S/C13H9N3O4/c17-11-3-6-20-13-9(7-15-5-4-14-8-15)1-2-10(12(11)13)16(18)19/h1-6,8H,7H2
InChIKey	YKATXTHPSQAGQZ-UHFFFAOYSA-N
PubChem Compound ID	10659706
Target and Pathway
Target(s)	Cytochrome P450 19	Target Info	Inhibitor	[535139]
BioCyc Pathway	Superpathway of steroid hormone biosynthesis
	Estradiol biosynthesis II
	Estradiol biosynthesis I
KEGG Pathway	Steroid hormone biosynthesis
	Metabolic pathways
	Ovarian steroidogenesis
NetPath Pathway	FSH Signaling Pathway
PANTHER Pathway	Androgen/estrogene/progesterone biosynthesis
PathWhiz Pathway	Androgen and Estrogen Metabolism
Reactome	Endogenous sterols
WikiPathways	Metapathway biotransformation
	Tryptophan metabolism
	Oxidation by Cytochrome P450
	Ovarian Infertility Genes
	Metabolism of steroid hormones and vitamin D
	FSH signaling pathway
	Integrated Breast Cancer Pathway
	Phase 1 - Functionalization of compounds
References
Ref 535139	A new class of nonsteroidal aromatase inhibitors: design and synthesis of chromone and xanthone derivatives and inhibition of the P450 enzymes aromatase and 17 alpha-hydroxylase/C17,20-lyase. J Med Chem. 2001 Mar 1;44(5):672-80.
Ref 535139	A new class of nonsteroidal aromatase inhibitors: design and synthesis of chromone and xanthone derivatives and inhibition of the P450 enzymes aromatase and 17 alpha-hydroxylase/C17,20-lyase. J Med Chem. 2001 Mar 1;44(5):672-80.

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