INDOMETHACIN GLUCURONIDE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C25H24ClNO10
Molecular Weight	533.912
Optical Activity	UNSPECIFIED
Defined Stereocenters	5 / 5
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

COC1=CC2=C(C=C1)N(C(=O)C3=CC=C(Cl)C=C3)C(C)=C2CC(=O)O[C@@H]4O[C@@H]([C@@H](O)[C@H](O)[C@H]4O)C(O)=O

InChI

InChIKey=QCBWEVBGELGABM-CZLVRFMKSA-N

InChI=1S/C25H24ClNO10/c1-11-15(10-18(28)36-25-21(31)19(29)20(30)22(37-25)24(33)34)16-9-14(35-2)7-8-17(16)27(11)23(32)12-3-5-13(26)6-4-12/h3-9,19-22,25,29-31H,10H2,1-2H3,(H,33,34)/t19-,20-,21+,22-,25+/m0/s1

HIDE SMILES / InChI

Molecular Formula	C25H24ClNO10
Molecular Weight	533.912
Charge	0
Count

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

Approval Year

Substance Class	Chemical Created by `admin` on `Tue Apr 01 21:52:30 GMT 2025` Edited by `admin` on `Tue Apr 01 21:52:30 GMT 2025`
Record UNII	B7MV2JQJ3W
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

(2S,3S,4S,5R,6S)-6-(2-(1-(4-CHLOROBENZOYL)-5-METHOXY-2-METHYL-INDOL-3-YL)ACETYL)OXY-3,4,5-TRIHYDROXY-TETRAHYDROPYRAN-2-CARBOXYLIC ACID

Preferred Name

English

INDOMETHACIN GLUCURONIDE

Common Name

English

.BETA.-D-GLUCOPYRANURONIC ACID, 1-(1-(4-CHLOROBENZOYL)-5-METHOXY-2-METHYL-1H-INDOLE-3-ACETATE)

Systematic Name

English

Code System Code Type Description

PUBCHEM

70691027

Created by admin on Tue Apr 01 21:52:30 GMT 2025 , Edited by admin on Tue Apr 01 21:52:30 GMT 2025

PRIMARY

CAS

75523-11-4

Created by admin on Tue Apr 01 21:52:30 GMT 2025 , Edited by admin on Tue Apr 01 21:52:30 GMT 2025

PRIMARY

FDA UNII

B7MV2JQJ3W

Created by admin on Tue Apr 01 21:52:30 GMT 2025 , Edited by admin on Tue Apr 01 21:52:30 GMT 2025

PRIMARY

Related Record Type Details


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INDOMETHACIN

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Amount: