TRYPAN BLUE FREE ACID

Details

Stereochemistry	ACHIRAL
Molecular Formula	C34H28N6O14S4
Molecular Weight	872.878
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	2
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CC1=CC(=CC=C1\N=N\C2=C(C=C3C=C(C=C(N)C3=C2O)S(O)(=O)=O)S(O)(=O)=O)C4=CC(C)=C(C=C4)\N=N\C5=C(O)C6=C(N)C=C(C=C6C=C5S(O)(=O)=O)S(O)(=O)=O

InChI

InChIKey=ZBNARPCCDMHDDV-HVMBLDELSA-N

InChI=1S/C34H28N6O14S4/c1-15-7-17(3-5-25(15)37-39-31-27(57(49,50)51)11-19-9-21(55(43,44)45)13-23(35)29(19)33(31)41)18-4-6-26(16(2)8-18)38-40-32-28(58(52,53)54)12-20-10-22(56(46,47)48)14-24(36)30(20)34(32)42/h3-14,41-42H,35-36H2,1-2H3,(H,43,44,45)(H,46,47,48)(H,49,50,51)(H,52,53,54)/b39-37+,40-38+

HIDE SMILES / InChI

Molecular Formula	C34H28N6O14S4
Molecular Weight	872.878
Charge	0
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 `Fri Dec 15 18:26:00 UTC 2023` Edited by `admin` on `Fri Dec 15 18:26:00 UTC 2023`
Record UNII	768N7QO4KH
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

TRYPAN BLUE FREE ACID

Common Name

English

2,7-NAPHTHALENEDISULFONIC ACID, 3,3'-((3,3'-DIMETHYL(1,1'-BIPHENYL)-4,4'-DIYL)BIS(AZO))BIS(5-AMINO-4-HYDROXY-

Common Name

English

Classification Tree Code System Code

NDF-RT

N0000175533