ELUXADOLINE DIHYDROCHLORIDE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C32H35N5O5.2ClH
Molecular Weight	642.573
Optical Activity	UNSPECIFIED
Defined Stereocenters	2 / 2
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of ELUXADOLINE DIHYDROCHLORIDE

Structure Search

SMILES

Cl.Cl.COC1=CC=C(CN([C@@H](C)C2=NC(=CN2)C3=CC=CC=C3)C(=O)[C@@H](N)CC4=C(C)C=C(C=C4C)C(N)=O)C=C1C(O)=O

InChI

InChIKey=YFUUQKJOCLQHMZ-ISJKLOBTSA-N

InChI=1S/C32H35N5O5.2ClH/c1-18-12-23(29(34)38)13-19(2)24(18)15-26(33)31(39)37(17-21-10-11-28(42-4)25(14-21)32(40)41)20(3)30-35-16-27(36-30)22-8-6-5-7-9-22;;/h5-14,16,20,26H,15,17,33H2,1-4H3,(H2,34,38)(H,35,36)(H,40,41);2*1H/t20-,26-;;/m0../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	C32H35N5O5
Molecular Weight	569.6508
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	2 / 2
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 04:58:02 UTC 2023` Edited by `admin` on `Sat Dec 16 04:58:02 UTC 2023`
Record UNII	7U4JQA48TT
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

ELUXADOLINE DIHYDROCHLORIDE

Common Name

English

BENZOIC ACID, 5-((((2S)-2-AMINO-3-(4-(AMINOCARBONYL)-2,6-DIMETHYLPHENYL)-1-OXOPROPYL)((1S)-1-(5-PHENYL-1H-IMIDAZOL-2-YL)ETHYL)AMINO)METHYL)-2-METHOXY-, HYDROCHLORIDE (1:2)

Systematic Name

English

ELUXADOLINE DIHYDROCHLORIDE [MI]

Common Name

English

MUDELTA

Brand Name

English

Code System Code Type Description

FDA UNII

7U4JQA48TT