9-BROMOPREGN-4-ENE-3,11,20-TRIONE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C21H27BrO3
Molecular Weight	407.341
Optical Activity	UNSPECIFIED
Defined Stereocenters	6 / 6
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 9-BROMOPREGN-4-ENE-3,11,20-TRIONE

Structure Search

SMILES

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

InChI

InChIKey=NWFOHSCPTMLQIH-GHMDXEKNSA-N

InChI=1S/C21H27BrO3/c1-12(23)15-6-7-16-17-5-4-13-10-14(24)8-9-20(13,3)21(17,22)18(25)11-19(15,16)2/h10,15-17H,4-9,11H2,1-3H3/t15-,16+,17+,19-,20+,21+/m1/s1

HIDE SMILES / InChI

Molecular Formula	C21H27BrO3
Molecular Weight	407.341
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	6 / 6
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 08:14:51 GMT 2023` Edited by `admin` on `Sat Dec 16 08:14:51 GMT 2023`
Record UNII	O784P63H1N
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

9-BROMOPREGN-4-ENE-3,11,20-TRIONE

Common Name

English

NSC-15990

Code

English

BROMOKETOPROGESTERONE

Common Name

English

BRAXARONE

Common Name

English

BRAXORON

Common Name

English

PREGN-4-ENE-3,11,20-TRIONE, 9-BROMO-

Common Name

English

Code System Code Type Description

FDA UNII

O784P63H1N