ANB

ANDROSTA-1,4-DIENE-3,17-DIONE

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is present as a standalone ligand in 5 entries

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Chemical Component Summary
Name	ANDROSTA-1,4-DIENE-3,17-DIONE
Identifiers	(8R,9S,10R,13S,14S)-10,13-dimethyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthrene-3,17-dione
Formula	C₁₉ H₂₄ O₂
Molecular Weight	284.393
Type	NON-POLYMER
Isomeric SMILES	C[C@]12CC[C@H]3[C@H]([C@@H]1CCC2=O)CCC4=CC(=O)C=C[C@]34C
InChI	InChI=1S/C19H24O2/c1-18-9-7-13(20)11-12(18)3-4-14-15-5-6-17(21)19(15,2)10-8-16(14)18/h7,9,11,14-16H,3-6,8,10H2,1-2H3/t14-,15-,16-,18-,19-/m0/s1
InChIKey	LUJVUUWNAPIQQI-QAGGRKNESA-N

Chemical Details
Formal Charge	0
Atom Count	45
Chiral Atom Count	5
Bond Count	48
Aromatic Bond Count	0

Drug Info: DrugBank

DrugBank ID	DB07373
Name	Boldione
Groups	experimental
Synonyms	Androstadienedione 1-Dehydroandrostenedione Androsta-1,4-diene-3,17-dione Boldione 1,4-Androstadiene-3,17-dione
Categories	Androstanes Androstenes Fused-Ring Compounds Steroids
CAS number	897-06-3

Drug Targets

Name	Target Sequence	Pharmacological Action	Actions
Pentaerythritol tetranitrate reductase	MSAEKLFTPLKVGAVTAPNRVFMAPLTRLRSIEPGDIPTPLMGEYYRQRA...	unknown

Drug Info/Drug Targets: DrugBank 3.0: a comprehensive resource for 'omics' research on drugs. Knox C, Law V, Jewison T, Liu P, Ly S, Frolkis A, Pon A, Banco K, Mak C, Neveu V, Djoumbou Y, Eisner R, Guo AC, Wishart DS. Nucleic Acids Res. 2011 Jan; 39 (Database issue):D1035-41. | PMID:21059682