JTP-27536

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C24H25NO4.C4H11NO3
Molecular Weight	512.5946
Optical Activity	UNSPECIFIED
Defined Stereocenters	1 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

NC(CO)(CO)CO.OC(=O)C1=CC2=C(C=C1)C(=O)N([C@H](CCC3CCCCC3)C4=CC=CC=C4)C2=O

InChI

InChIKey=UEMZZDQCKZSDJA-ZMBIFBSDSA-N

InChI=1S/C24H25NO4.C4H11NO3/c26-22-19-13-12-18(24(28)29)15-20(19)23(27)25(22)21(17-9-5-2-6-10-17)14-11-16-7-3-1-4-8-16;5-4(1-6,2-7)3-8/h2,5-6,9-10,12-13,15-16,21H,1,3-4,7-8,11,14H2,(H,28,29);6-8H,1-3,5H2/t21-;/m1./s1

HIDE SMILES / InChI

Molecular Formula	C4H11NO3
Molecular Weight	121.135
Charge	0
Count

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

Molecular Formula	C24H25NO4
Molecular Weight	391.4596
Charge	0
Count

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

Approval Year

PubMed

Title	Date	PubMed
JTP-27536 [(+)-1,3-dihydroxy-2-hydroxymethylpropyl-2-ammonium 2-[(R)-3-cyclo-hexyl-1-phenylpropyl]-1,3-dioxo-2,3-dihydro-1H-isoindole-5-carboxylate monohydrate], a novel inhibitor of immunoglobulins and interleukin-5 with anti-inflammatory properties in mouse allergic dermatitis model.	2005 Jul	15821026

Substance Class	Chemical Created by `admin` on `Sat Dec 16 08:42:55 GMT 2023` Edited by `admin` on `Sat Dec 16 08:42:55 GMT 2023`
Record UNII	34RCU15W5B
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

JTP-27536

Common Name

English

1H-ISOINDOLE-5-CARBOXYLIC ACID, 2-((1R)-3-CYCLOHEXYL-1-PHENYLPROPYL)-2,3-DIHYDRO-1,3-DIOXO-, COMPD. WITH 2-AMINO-2-(HYDROXYMETHYL)-1,3-PROPANEDIOL (1:1)

Systematic Name

English

1,3-PROPANEDIOL, 2-AMINO-2-(HYDROXYMETHYL)-, 2-((1R)-3-CYCLOHEXYL-1-PHENYLPROPYL)-2,3-DIHYDRO-1,3-DIOXO-1H-ISOINDOLE-5-CARBOXYLATE (SALT)

Systematic Name

English

Code System Code Type Description

CAS

216681-21-9

Created by admin on Sat Dec 16 08:42:56 GMT 2023 , Edited by admin on Sat Dec 16 08:42:56 GMT 2023

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FDA UNII

34RCU15W5B

Created by admin on Sat Dec 16 08:42:56 GMT 2023 , Edited by admin on Sat Dec 16 08:42:56 GMT 2023

PRIMARY

PUBCHEM

11489138

Created by admin on Sat Dec 16 08:42:56 GMT 2023 , Edited by admin on Sat Dec 16 08:42:56 GMT 2023

PRIMARY

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