CARBOXYIBUPROFEN-GLUCURONIDE

Details

Stereochemistry	MIXED
Molecular Formula	C19H24O10
Molecular Weight	412.3879
Optical Activity	UNSPECIFIED
Defined Stereocenters	5 / 7
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of CARBOXYIBUPROFEN-GLUCURONIDE

Structure Search

SMILES

CC(CC1=CC=C(C=C1)C(C)C(=O)O[C@@H]2O[C@@H]([C@@H](O)[C@H](O)[C@H]2O)C(O)=O)C(O)=O

InChI

InChIKey=FLVLKWAQHDRIPH-DGHDQTINSA-N

InChI=1S/C19H24O10/c1-8(16(23)24)7-10-3-5-11(6-4-10)9(2)18(27)29-19-14(22)12(20)13(21)15(28-19)17(25)26/h3-6,8-9,12-15,19-22H,7H2,1-2H3,(H,23,24)(H,25,26)/t8?,9?,12-,13-,14+,15-,19-/m0/s1

HIDE SMILES / InChI

Molecular Formula	C19H24O10
Molecular Weight	412.3879
Charge	0
Count

Stereochemistry	MIXED
Additional Stereochemistry	No
Defined Stereocenters	5 / 7
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 13:38:41 GMT 2023` Edited by `admin` on `Sat Dec 16 13:38:41 GMT 2023`
Record UNII	L943Z69B8Y
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

CARBOXYIBUPROFEN-GLUCURONIDE

Common Name

English

.BETA.-D-GLUCOPYRANURONIC ACID, 1-(4-(2-CARBOXYPROPYL)-.ALPHA.-METHYLBENZENEACETATE)

Systematic Name

English

Code System Code Type Description

CAS

171979-65-0

Created by admin on Sat Dec 16 13:38:41 GMT 2023 , Edited by admin on Sat Dec 16 13:38:41 GMT 2023

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PUBCHEM

135390721

Created by admin on Sat Dec 16 13:38:41 GMT 2023 , Edited by admin on Sat Dec 16 13:38:41 GMT 2023

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FDA UNII

L943Z69B8Y

Created by admin on Sat Dec 16 13:38:41 GMT 2023 , Edited by admin on Sat Dec 16 13:38:41 GMT 2023

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Related Record Type Details


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IBUPROFEN

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