GW-870086

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C31H39F2NO6
Molecular Weight	559.6413
Optical Activity	UNSPECIFIED
Defined Stereocenters	9 / 9
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[H][C@@]12C[C@@H](C)[C@](OC(=O)C3C(C)(C)C3(C)C)(C(=O)OCC#N)[C@@]1(C)C[C@H](O)[C@@]4(F)[C@@]2([H])C[C@H](F)C5=CC(=O)C=C[C@]45C

InChI

InChIKey=WUBKGTSFJSEIEM-NSHBDUGJSA-N

InChI=1S/C31H39F2NO6/c1-16-12-18-19-14-21(32)20-13-17(35)8-9-28(20,6)30(19,33)22(36)15-29(18,7)31(16,25(38)39-11-10-34)40-24(37)23-26(2,3)27(23,4)5/h8-9,13,16,18-19,21-23,36H,11-12,14-15H2,1-7H3/t16-,18+,19+,21+,22+,28+,29+,30+,31+/m1/s1

HIDE SMILES / InChI

Molecular Formula	C31H39F2NO6
Molecular Weight	559.6413
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	9 / 9
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 08:16:33 UTC 2023` Edited by `admin` on `Sat Dec 16 08:16:33 UTC 2023`
Record UNII	O891A2A3ZU
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

GW-870086

Common Name

English

ANDROSTA-1,4-DIENE-17-CARBOXYLIC ACID, 6,9-DIFLUORO-11-HYDROXY-16-METHYL-3-OXO-17-(((2,2,3,3-TETRAMETHYLCYCLOPROPYL)CARBONYL)OXY)-, CYANOMETHYL ESTER, (6.ALPHA.,11.BETA.,16.ALPHA.,17.ALPHA.)-

Systematic Name

English

GW870086

Code

English

GW870086X

Code

English

Code System Code Type Description

DRUG BANK

DB12322