3QZ

(9beta)-17-hydroxypregn-4-ene-3,20-dione

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is present as a standalone ligand in 5 entries

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Chemical Component Summary
Name	(9beta)-17-hydroxypregn-4-ene-3,20-dione
Identifiers	(8R,9S,10R,13S,14S,17R)-17-ethanoyl-17-hydroxy-10,13-dimethyl-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-3-one
Formula	C₂₁ H₃₀ O₃
Molecular Weight	330.461
Type	NON-POLYMER
Isomeric SMILES	CC(=O)[C@]1(CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CCC4=CC(=O)CC[C@]34C)C)O
InChI	InChI=1S/C21H30O3/c1-13(22)21(24)11-8-18-16-5-4-14-12-15(23)6-9-19(14,2)17(16)7-10-20(18,21)3/h12,16-18,24H,4-11H2,1-3H3/t16-,17+,18+,19+,20+,21+/m1/s1
InChIKey	DBPWSSGDRRHUNT-CEGNMAFCSA-N

Chemical Details
Formal Charge	0
Atom Count	54
Chiral Atom Count	6
Bond Count	57
Aromatic Bond Count	0

Drug Info: DrugBank

DrugBank ID	DB14570 ?
Name	Hydroxyprogesterone
Groups	experimental
Synonyms	17-Hydroxypregn-4-en-3,20-dione Pregn-4-ene-3,20-dione-17-ol 17alpha-hydroxyprogesterone 17α-hydroxyprogesterone Hydroxyprogesterone 17-hydroxyprogesterone Hydroxyprogesteronum Hidroxiprogesterona delta(4)-Pregnene-17alpha-ol-3,20-dione
Categories	Adrenal Cortex Hormones Cytochrome P-450 CYP3A Substrates Cytochrome P-450 CYP3A4 Substrates Cytochrome P-450 Substrates Fused-Ring Compounds Genito Urinary System and Sex Hormones Gonadal Hormones Gonadal Steroid Hormones Hormones Hormones, Hormone Substitutes, and Hormone Antagonists Hydroxyprogesterones Pregnanes Pregnen (4) Derivatives Pregnenediones Pregnenes Progesterone and Derivatives Progesterone Congeners Progestins Sex Hormones and Modulators of the Genital System Steroids
ATC-Code	G03FA02 G03DA03
CAS number	68-96-2

Drug Targets

Name	Target Sequence	Pharmacological Action	Actions
Cytochrome P450 3A4	MALIPDLAMETWLLLAVSLVLLYLYGTHSHGLFKKLGIPGPTPLPFLGNI...	unknown	substrate

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