HC ORANGE NO. 6

Details

Stereochemistry	ACHIRAL
Molecular Formula	C38H48N4O4S2.2CH3O3S
Molecular Weight	879.138
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	2
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CS([O-])(=O)=O.CS([O-])(=O)=O.OCCN(CCO)C1=CC=C(\C=C\C2=[N+](CCSSCC[N+]3=C(\C=C\C4=CC=C(C=C4)N(CCO)CCO)C=CC=C3)C=CC=C2)C=C1

InChI

InChIKey=LOGITAXZYWCDHX-UHFFFAOYSA-L

InChI=1S/C38H48N4O4S2.2CH4O3S/c43-27-21-41(22-28-44)37-15-9-33(10-16-37)7-13-35-5-1-3-19-39(35)25-31-47-48-32-26-40-20-4-2-6-36(40)14-8-34-11-17-38(18-12-34)42(23-29-45)24-30-46;2*1-5(2,3)4/h1-20,43-46H,21-32H2;2*1H3,(H,2,3,4)/q+2;;/p-2

HIDE SMILES / InChI

Molecular Formula	CH3O3S
Molecular Weight	95.098
Charge	-1
Count

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

Molecular Formula	C38H48N4O4S2
Molecular Weight	688.942
Charge	2
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 23:31:30 GMT 2025` Edited by `admin` on `Mon Mar 31 23:31:30 GMT 2025`
Record UNII	PKS7O14JK4
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

HC ORANGE NO. 6

Official Name

English

PYRIDINIUM, 1,1'-(DITHIODI-2,1-ETHANEDIYL)BIS(2-((1E)-2-(4-(BIS(2-HYDROXYETHYL)AMINO)PHENYL)ETHENYL)-, METHANESULFONATE (1:2)

Preferred Name

English

Code System Code Type Description

PUBCHEM

91936860

Created by admin on Mon Mar 31 23:31:30 GMT 2025 , Edited by admin on Mon Mar 31 23:31:30 GMT 2025

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CAS

1449653-83-1

Created by admin on Mon Mar 31 23:31:30 GMT 2025 , Edited by admin on Mon Mar 31 23:31:30 GMT 2025

PRIMARY

FDA UNII

PKS7O14JK4

Created by admin on Mon Mar 31 23:31:30 GMT 2025 , Edited by admin on Mon Mar 31 23:31:30 GMT 2025

PRIMARY