OXOCULARINE

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C19H15NO5
Molecular Weight	337.3261
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of OXOCULARINE

Structure Search

SMILES

COC1=CC2=C(C=C1OC)C(=O)C3=C4C(C=CC(OC)=C4O2)=CC=N3

InChI

InChIKey=AGKDNGLOUYCNMU-UHFFFAOYSA-N

InChI=1S/C19H15NO5/c1-22-12-5-4-10-6-7-20-17-16(10)19(12)25-13-9-15(24-3)14(23-2)8-11(13)18(17)21/h4-9H,1-3H3

HIDE SMILES / InChI

Molecular Formula	C19H15NO5
Molecular Weight	337.3261
Charge	0
Count

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

Approval Year

Substance Class	Chemical Created by `admin` on `Wed Apr 02 13:10:13 GMT 2025` Edited by `admin` on `Wed Apr 02 13:10:13 GMT 2025`
Record UNII	WD23CL3J85
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

OXOCULARINE

Common Name

English

NSC-607980

Preferred Name

English

6,9,10-TRIMETHOXY-12H-(1)BENZOXEPINO(2,3,4-IJ)ISOQUINOLIN-12-ONE

Systematic Name

English

12H-(1)BENZOXEPINO(2,3,4-IJ)ISOQUINOLIN-12-ONE, 6,9,10-TRIMETHOXY-

Systematic Name

English

Code System Code Type Description

NSC

607980

Created by admin on Wed Apr 02 13:10:13 GMT 2025 , Edited by admin on Wed Apr 02 13:10:13 GMT 2025

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EPA CompTox

DTXSID60187568

Created by admin on Wed Apr 02 13:10:13 GMT 2025 , Edited by admin on Wed Apr 02 13:10:13 GMT 2025

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CAS

3395-23-1

Created by admin on Wed Apr 02 13:10:13 GMT 2025 , Edited by admin on Wed Apr 02 13:10:13 GMT 2025

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FDA UNII

WD23CL3J85

Created by admin on Wed Apr 02 13:10:13 GMT 2025 , Edited by admin on Wed Apr 02 13:10:13 GMT 2025

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PUBCHEM

73044

Created by admin on Wed Apr 02 13:10:13 GMT 2025 , Edited by admin on Wed Apr 02 13:10:13 GMT 2025

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