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Details

Stereochemistry ACHIRAL
Molecular Formula C38H25N6O12S3.3Na
Molecular Weight 922.802
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 2
Charge 0

SHOW SMILES / InChI
Structure of DIRECT RED 73

SMILES

[Na+].[Na+].[Na+].CC1=CC=CC=C1\N=N\C2=C(O)C3=C(C=C(NC(=O)NC4=CC=C5C(=C4)C=C(C(\N=N\C6=CC=C7C=C(C=CC7=C6)S([O-])(=O)=O)=C5O)S([O-])(=O)=O)C=C3)C=C2S([O-])(=O)=O

InChI

InChIKey=ATRALPSKQPQOTB-NHBKGLTJSA-K
InChI=1S/C38H28N6O12S3.3Na/c1-20-4-2-3-5-31(20)42-44-35-33(59(54,55)56)19-24-16-26(10-13-30(24)37(35)46)40-38(47)39-25-9-12-29-23(15-25)18-32(58(51,52)53)34(36(29)45)43-41-27-8-6-22-17-28(57(48,49)50)11-7-21(22)14-27;;;/h2-19,45-46H,1H3,(H2,39,40,47)(H,48,49,50)(H,51,52,53)(H,54,55,56);;;/q;3*+1/p-3/b43-41+,44-42+;;;

HIDE SMILES / InChI

Molecular Formula Na
Molecular Weight 22.98976928
Charge 1
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C38H25N6O12S3
Molecular Weight 853.833
Charge -3
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 2
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Mon Mar 31 21:50:41 GMT 2025
Edited
by admin
on Mon Mar 31 21:50:41 GMT 2025
Record UNII
22G2CBI4TO
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
DIRECT RED 73
Common Name English
C.I. 29180
Preferred Name English
NSC-58057
Code English
C.I. DIRECT RED 73, TRISODIUM SALT
Common Name English
CI 29180
Code English
2-NAPHTHALENESULFONIC ACID, 4-HYDROXY-7-((((5-HYDROXY-6-(2-(2-METHYLPHENYL)DIAZENYL)-7-SULFO-2-NAPHTHALENYL)AMINO)CARBONYL)AMINO)-3-(2-(6-SULFO-2-NAPHTHALENYL)DIAZENYL)-, SODIUM SALT (1:3)
Systematic Name English
C.I. DIRECT RED 73
Common Name English
Code System Code Type Description
ECHA (EC/EINECS)
229-273-6
Created by admin on Mon Mar 31 21:50:41 GMT 2025 , Edited by admin on Mon Mar 31 21:50:41 GMT 2025
PRIMARY
NSC
58057
Created by admin on Mon Mar 31 21:50:41 GMT 2025 , Edited by admin on Mon Mar 31 21:50:41 GMT 2025
PRIMARY
EPA CompTox
DTXSID20889551
Created by admin on Mon Mar 31 21:50:41 GMT 2025 , Edited by admin on Mon Mar 31 21:50:41 GMT 2025
PRIMARY
FDA UNII
22G2CBI4TO
Created by admin on Mon Mar 31 21:50:41 GMT 2025 , Edited by admin on Mon Mar 31 21:50:41 GMT 2025
PRIMARY
CAS
6460-01-1
Created by admin on Mon Mar 31 21:50:41 GMT 2025 , Edited by admin on Mon Mar 31 21:50:41 GMT 2025
PRIMARY
Related Record Type Details
PARENT -> SALT/SOLVATE