ABEQUOLIXRON HYDROCHLORIDE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C34H33ClF3NO3.ClH
Molecular Weight	632.54
Optical Activity	UNSPECIFIED
Defined Stereocenters	1 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

Cl.C[C@H](CCOC1=CC(CC(O)=O)=CC=C1)N(CC(C2=CC=CC=C2)C3=CC=CC=C3)CC4=C(Cl)C(=CC=C4)C(F)(F)F

InChI

InChIKey=LCMIYQOJZLRHTO-GJFSDDNBSA-N

InChI=1S/C34H33ClF3NO3.ClH/c1-24(18-19-42-29-16-8-10-25(20-29)21-32(40)41)39(22-28-15-9-17-31(33(28)35)34(36,37)38)23-30(26-11-4-2-5-12-26)27-13-6-3-7-14-27;/h2-17,20,24,30H,18-19,21-23H2,1H3,(H,40,41);1H/t24-;/m1./s1

HIDE SMILES / InChI

Molecular Formula	ClH
Molecular Weight	36.461
Charge	0
Count

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

Molecular Formula	C34H33ClF3NO3
Molecular Weight	596.079
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	1 / 1
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 12:35:06 UTC 2023` Edited by `admin` on `Sat Dec 16 12:35:06 UTC 2023`
Record UNII	D32013XLTX
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

ABEQUOLIXRON HYDROCHLORIDE

Common Name

English

BENZENEACETIC ACID, 3-((3R)-3-(((2-CHLORO-3-(TRIFLUOROMETHYL)PHENYL)METHYL)(2,2-DIPHENYLETHYL)AMINO)BUTOXY)-, HYDROCHLORIDE (1:1)

Systematic Name

English

(3-((3R)-3-(((2-CHLORO-3-(TRIFLUOROMETHYL)PHENYL)METHYL)(2,2- DIPHENYLETHYL)AMINO)BUTOXY)PHENYL)ACETIC ACID HYDROCHLORIDE

Systematic Name

English

SB-742881 HYDROCHLORIDE

Code

English

RGX-104 HYDROCHLORIDE

Code

English

Code System Code Type Description

PUBCHEM

68861574

Created by admin on Sat Dec 16 12:35:06 UTC 2023 , Edited by admin on Sat Dec 16 12:35:06 UTC 2023

PRIMARY

FDA UNII

D32013XLTX

Created by admin on Sat Dec 16 12:35:06 UTC 2023 , Edited by admin on Sat Dec 16 12:35:06 UTC 2023

PRIMARY

CAS

610318-03-1

Created by admin on Sat Dec 16 12:35:06 UTC 2023 , Edited by admin on Sat Dec 16 12:35:06 UTC 2023

PRIMARY

Related Record Type Details


					Q26B92650V

ABEQUOLIXRON

PARENT -> SALT/SOLVATE

Related Record Type Details


					Q26B92650V

ABEQUOLIXRON

ACTIVE MOIETY