REVATROPATE HYDROBROMIDE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C19H27NO4S.BrH
Molecular Weight	446.399
Optical Activity	UNSPECIFIED
Defined Stereocenters	3 / 3
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

Br.C[S@@+]([O-])CC[C@](CO)(C(=O)O[C@H]1CN2CCC1CC2)C3=CC=CC=C3

InChI

InChIKey=WUBKMAXEHQTPBW-XPTPVYCOSA-N

InChI=1S/C19H27NO4S.BrH/c1-25(23)12-9-19(14-21,16-5-3-2-4-6-16)18(22)24-17-13-20-10-7-15(17)8-11-20;/h2-6,15,17,21H,7-14H2,1H3;1H/t17-,19+,25+;/m0./s1

HIDE SMILES / InChI

Molecular Formula	BrH
Molecular Weight	80.912
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Molecular Formula	C19H27NO4S
Molecular Weight	365.487
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	3 / 3
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 11:49:14 UTC 2023` Edited by `admin` on `Sat Dec 16 11:49:14 UTC 2023`
Record UNII	5M406XG20G
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

REVATROPATE HYDROBROMIDE

Common Name

English

BENZENEACETIC ACID, .ALPHA.-(HYDROXYMETHYL)-.ALPHA.-(2-((R)-METHYLSULFINYL)ETHYL)-, (3R)-1-AZABICYCLO(2.2.2)OCT-3-YL ESTER, HYDROBROMIDE (1:1), (.ALPHA.S)-

Systematic Name

English

UK-112,166-04

Code

English

UK-112166-04

Code

English

BENZENEACETIC ACID, .ALPHA.-(HYDROXYMETHYL)-.ALPHA.-(2-((R)-METHYLSULFINYL)ETHYL)-, (3R)-1-AZABICYCLO(2.2.2)OCT-3-YL ESTER, HYDROBROMIDE, (.ALPHA.S)-

Systematic Name

English

Code System Code Type Description

CAS

262586-79-8

Created by admin on Sat Dec 16 11:49:14 UTC 2023 , Edited by admin on Sat Dec 16 11:49:14 UTC 2023

PRIMARY

PUBCHEM

69288197

Created by admin on Sat Dec 16 11:49:14 UTC 2023 , Edited by admin on Sat Dec 16 11:49:14 UTC 2023

PRIMARY

FDA UNII

5M406XG20G

Created by admin on Sat Dec 16 11:49:14 UTC 2023 , Edited by admin on Sat Dec 16 11:49:14 UTC 2023

PRIMARY

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