D&C RED NO. 33 ALUMINUM LAKE

Details

Stereochemistry	ACHIRAL
Molecular Formula	3C16H11N3O7S2.2Al
Molecular Weight	1318.176
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	3
Charge	0

SHOW SMILES / InChI

Structure of D&C RED NO. 33 ALUMINUM LAKE

Structure Search

SMILES

[Al+3].[Al+3].NC1=CC(=CC2=CC(=C(\N=N\C3=CC=CC=C3)C(O)=C12)S([O-])(=O)=O)S([O-])(=O)=O.NC4=CC(=CC5=CC(=C(\N=N\C6=CC=CC=C6)C(O)=C45)S([O-])(=O)=O)S([O-])(=O)=O.NC7=CC(=CC8=CC(=C(\N=N\C9=CC=CC=C9)C(O)=C78)S([O-])(=O)=O)S([O-])(=O)=O

InChI

InChIKey=OVZVIWRHCWZKOH-XIGFGSSXSA-H

InChI=1S/3C16H13N3O7S2.2Al/c3*17-12-8-11(27(21,22)23)6-9-7-13(28(24,25)26)15(16(20)14(9)12)19-18-10-4-2-1-3-5-10;;/h3*1-8,20H,17H2,(H,21,22,23)(H,24,25,26);;/q;;;2*+3/p-6/b3*19-18+;;

HIDE SMILES / InChI

Molecular Formula	C16H11N3O7S2
Molecular Weight	421.404
Charge	-2
Count

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

Molecular Formula	Al
Molecular Weight	26.9815386
Charge	3
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 21:09:47 GMT 2025` Edited by `admin` on `Wed Apr 02 21:09:47 GMT 2025`
Record UNII	L3FT3LUT29
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

D&C RED NO. 33 ALUMINUM LAKE

Official Name

English

Aluminum, tris[5-amino-4-hydroxy-3-(2-phenyldiazenyl)-2,7-naphthalenedisulfonato(2-)]di-

Preferred Name

English

Tris[5-amino-4-hydroxy-3-(2-phenyldiazenyl)-2,7-naphthalenedisulfonato(2-)]dialuminum

Systematic Name

English

Code System Code Type Description

EPA CompTox

DTXSID001018664