ROXIBOLONE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C21H28O5
Molecular Weight	360.444
Optical Activity	UNSPECIFIED
Defined Stereocenters	7 / 7
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[H][C@@]12CC[C@](C)(O)[C@@]1(C)C[C@H](O)[C@@]3([H])[C@@]2([H])CCC4=CC(=O)C(=C[C@]34C)C(O)=O

InChI

InChIKey=JOFBZBDWOWPUMO-QARKFJNLSA-N

InChI=1S/C21H28O5/c1-19-9-13(18(24)25)15(22)8-11(19)4-5-12-14-6-7-21(3,26)20(14,2)10-16(23)17(12)19/h8-9,12,14,16-17,23,26H,4-7,10H2,1-3H3,(H,24,25)/t12-,14-,16-,17+,19-,20-,21-/m0/s1

HIDE SMILES / InChI

Molecular Formula	C21H28O5
Molecular Weight	360.444
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	7 / 7
E/Z Centers	0
Optical Activity	UNSPECIFIED

Description
Sources: https://www.ncbi.nlm.nih.gov/pubmed/6523544 | https://www.ncbi.nlm.nih.gov/pubmed/3790189

Roxibolone, an androstane derivative, possesses the anti-glucocorticoid activity and devoid of any affinity for the androgenic prostate and muscle receptors. This anabolic drug has never been marketed.

Approval Year

PubMed

Title	Date	PubMed
Synthesis of 2-carboxy-11 beta, 17 beta-dihydroxy-17-methyl-1, 4-androstadien-3-one and related compounds.	1984 Mar	6523544
Androstane derivatives--roxibolone and decylroxibolone--devoid of any affinity for the androgenic prostate and muscle receptors.	1986 Sep	3790189

Patents

Substance Class	Chemical Created by `admin` on `Fri Dec 15 16:31:04 GMT 2023` Edited by `admin` on `Fri Dec 15 16:31:04 GMT 2023`
Record UNII	3R7NLP419C
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

ROXIBOLONE

Official Name

English

roxibolone [INN]

Common Name

English

BR-906

Code

English

ANDROSTA-1,4-DIENE-2-CARBOXYLIC ACID, 11,17-DIHYDROXY-17-METHYL-3-OXO-, (11.BETA.,17.BETA.)-

Common Name

English

11.BETA.,17.BETA.-DIHYDROXY-17-METHYL-3-OXOANDROSTA-1,4-DIENE-2-CARBOXYLIC ACID

Common Name

English

Classification Tree Code System Code

NCI_THESAURUS

C2360