PYRIMINOBAC

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C16H17N3O6
Molecular Weight	347.3227
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	1
Charge	0

SHOW SMILES / InChI

Structure of PYRIMINOBAC

Structure Search

SMILES

CON=C(C)C1=CC=CC(OC2=NC(OC)=CC(OC)=N2)=C1C(O)=O

InChI

InChIKey=DEIKMOQTJBGGAX-UHFFFAOYSA-N

InChI=1S/C16H17N3O6/c1-9(19-24-4)10-6-5-7-11(14(10)15(20)21)25-16-17-12(22-2)8-13(18-16)23-3/h5-8H,1-4H3,(H,20,21)

HIDE SMILES / InChI

Molecular Formula	C16H17N3O6
Molecular Weight	347.3227
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	1
Optical Activity	NONE

Approval Year

Substance Class	Chemical Created by `admin` on `Mon Mar 31 19:21:38 GMT 2025` Edited by `admin` on `Mon Mar 31 19:21:38 GMT 2025`
Record UNII	324VPI7F2Z
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

PYRIMINOBAC [ISO]

Preferred Name

English

PYRIMINOBAC

Common Name

English

BENZOIC ACID, 2-((4,6-DIMETHOXY-2-PYRIMIDINYL)OXY)-6-(1-(METHOXYIMINO)ETHYL)-

Systematic Name

English

Code System Code Type Description

ALANWOOD

pyriminobac

Created by admin on Mon Mar 31 19:21:38 GMT 2025 , Edited by admin on Mon Mar 31 19:21:38 GMT 2025

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CAS

136191-56-5

Created by admin on Mon Mar 31 19:21:38 GMT 2025 , Edited by admin on Mon Mar 31 19:21:38 GMT 2025

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PUBCHEM

20056437

Created by admin on Mon Mar 31 19:21:38 GMT 2025 , Edited by admin on Mon Mar 31 19:21:38 GMT 2025

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EPA CompTox

DTXSID80869854

Created by admin on Mon Mar 31 19:21:38 GMT 2025 , Edited by admin on Mon Mar 31 19:21:38 GMT 2025

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FDA UNII

324VPI7F2Z

Created by admin on Mon Mar 31 19:21:38 GMT 2025 , Edited by admin on Mon Mar 31 19:21:38 GMT 2025

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