.BETA.-HYDROXY SPIROCYCLOPENTANE IRBESARTAN

Details

Stereochemistry	UNKNOWN
Molecular Formula	C25H28N6O2
Molecular Weight	444.5288
Optical Activity	UNSPECIFIED
Defined Stereocenters	0 / 2
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of .BETA.-HYDROXY SPIROCYCLOPENTANE IRBESARTAN

Structure Search

SMILES

CCCCC1=NC2(CCC(O)C2)C(=O)N1CC3=CC=C(C=C3)C4=C(C=CC=C4)C5=NN=NN5

InChI

InChIKey=SGLAKMDXJPVHBY-UHFFFAOYSA-N

InChI=1S/C25H28N6O2/c1-2-3-8-22-26-25(14-13-19(32)15-25)24(33)31(22)16-17-9-11-18(12-10-17)20-6-4-5-7-21(20)23-27-29-30-28-23/h4-7,9-12,19,32H,2-3,8,13-16H2,1H3,(H,27,28,29,30)

HIDE SMILES / InChI

Molecular Formula	C25H28N6O2
Molecular Weight	444.5288
Charge	0
Count

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

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 09:27:30 GMT 2023` Edited by `admin` on `Sat Dec 16 09:27:30 GMT 2023`
Record UNII	2E7LC67Q7U
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

.BETA.-HYDROXY SPIROCYCLOPENTANE IRBESARTAN

Common Name

English

HYDROXYIRBESARTAN, (AT ONE OF THE POSITIONS .BETA. TO THE SPIRO CARBON ATOM)-

Common Name

English

1,3-DIAZASPIRO(4.4)NON-1-EN-4-ONE, 2-BUTYL-7-HYDROXY-3-((2'-(2H-TETRAZOL-5-YL)(1,1'-BIPHENYL)-4-YL)METHYL)-

Systematic Name

English

IRBESARTAN METABOLITE 7

Common Name

English

IRBESARTAN METABOLITE 5

Common Name

English

Code System Code Type Description

CAS

208988-53-8

Created by admin on Sat Dec 16 09:27:30 GMT 2023 , Edited by admin on Sat Dec 16 09:27:30 GMT 2023

ALTERNATIVE

PUBCHEM

101944494

Created by admin on Sat Dec 16 09:27:30 GMT 2023 , Edited by admin on Sat Dec 16 09:27:30 GMT 2023

PRIMARY

CAS

208988-52-7

Created by admin on Sat Dec 16 09:27:30 GMT 2023 , Edited by admin on Sat Dec 16 09:27:30 GMT 2023

PRIMARY

FDA UNII

2E7LC67Q7U

Created by admin on Sat Dec 16 09:27:30 GMT 2023 , Edited by admin on Sat Dec 16 09:27:30 GMT 2023

PRIMARY

Related Record Type Details


					J0E2756Z7N

IRBESARTAN

PARENT -> METABOLITE

Comments:

M5+M6+M7 is 24.2(iv) and 25.3 (oral) in feces. Plasma content should be very low

Qualification:

URINE

Amount: