5.BETA.-DUTASTERIDE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C27H30F6N2O2
Molecular Weight	528.5297
Optical Activity	UNSPECIFIED
Defined Stereocenters	7 / 7
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[H][C@@]12CC[C@H](C(=O)NC3=CC(=CC=C3C(F)(F)F)C(F)(F)F)[C@@]1(C)CC[C@@]4([H])[C@@]2([H])CC[C@]5([H])NC(=O)C=C[C@]45C

InChI

InChIKey=JWJOTENAMICLJG-LKOHVCGWSA-N

InChI=1S/C27H30F6N2O2/c1-24-11-9-17-15(4-8-21-25(17,2)12-10-22(36)35-21)16(24)6-7-19(24)23(37)34-20-13-14(26(28,29)30)3-5-18(20)27(31,32)33/h3,5,10,12-13,15-17,19,21H,4,6-9,11H2,1-2H3,(H,34,37)(H,35,36)/t15-,16-,17-,19+,21-,24-,25+/m0/s1

HIDE SMILES / InChI

Molecular Formula	C27H30F6N2O2
Molecular Weight	528.5297
Charge	0
Count

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

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 08:15:31 GMT 2023` Edited by `admin` on `Sat Dec 16 08:15:31 GMT 2023`
Record UNII	QC5T8YXW43
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

5.BETA.-DUTASTERIDE

Common Name

English

1H-INDENO(5,4-F)QUINOLINE-7-CARBOXAMIDE, N-(2,5-BIS(TRIFLUOROMETHYL)PHENYL)-2,4A,4B,5,6,6A,7,8,9,9A,9B,10,11,11A-TETRADECAHYDRO-4A,6A-DIMETHYL-2-OXO-, (4AR,4BS,6AS,7S,9AS,9BS,11AS)

Systematic Name

English

(4AR,4BS,6AS,7S,9AS,9BS,11AS)-N-(2,5-BIS(TRIFLUOROMETHYL)PHENYL)-2,4A,4B,5,6,6A,7,8,9,9A,9B,10,11,11A-TETRADECAHYDRO-4A,6A-DIMETHYL-2-OXO-1H-INDENO(5,4-F)QUINOLINE-7-CARBOXAMIDE

Systematic Name

English

Code System Code Type Description

PUBCHEM

92403462

Created by admin on Sat Dec 16 08:15:31 GMT 2023 , Edited by admin on Sat Dec 16 08:15:31 GMT 2023

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EPA CompTox

DTXSID20861433

Created by admin on Sat Dec 16 08:15:31 GMT 2023 , Edited by admin on Sat Dec 16 08:15:31 GMT 2023

PRIMARY

CAS

957229-52-6

Created by admin on Sat Dec 16 08:15:31 GMT 2023 , Edited by admin on Sat Dec 16 08:15:31 GMT 2023

PRIMARY

FDA UNII

QC5T8YXW43

Created by admin on Sat Dec 16 08:15:31 GMT 2023 , Edited by admin on Sat Dec 16 08:15:31 GMT 2023

PRIMARY

Related Record Type Details


					O0J6XJN02I

DUTASTERIDE

PARENT -> IMPURITY