Details of the Drug Inactive Ingredient (DIG)

General Information of DIG (ID: E0Q9KG)
DIG Name
Light green SF yellowish
Synonyms    Click to Show/Hide the Synonyms of This DIG
Light Green SF Yellowish; Acid Green 5; 5141-20-8; Light Green G; Light green SF; Lissamine Green SF; A F Green No.2; Amacid Green G; Light Green S; Pencil Green SF; Sulfo Green J; Light Green CF; Light Green FS; Light Green Lake; Fenazo Green 7G; Leather Green SF; Light Green SFA; Light Green SFD; Acilan Green SFG; Acid Brilliant Green SF; FD&C Green No. 2; Food Green 2; Light Green 2GN; Wool Brilliant Green SF; C.I. Acid Green 5; A.F. Green No. 2; Merantine Green SF; Fast Acid Green N; Lichtgruen; Light Green Yellowish; Acidal Light Green SF; D&C Green No. 2; Green No. 203; Lissamine Lake Green SF; D And C Green No. 4; Light Green FCF Yellowish; FD and C Green No. 4; CCRIS 889; C.I. Food Green 2; FD and C Green No. 2; Sumitomo Light Green SF Yellowish; C.I. ACID GREEN 5, DISODIUM SALT; NSC 9619; UNII-3F7BHA64Z0; MFCD00012121; C.I. 42095; Light SF Yellowish (Biological stain); C.I. 670; MY/68; 3F7BHA64Z0; FD And C Green No. 2-Aluminum Lake; Lichtgruen [German]; Zelen kysela F [Czech]; Zelen kysela 5 [Czech]; Zelen kysela F; Zelen svetla SF [Czech]; Zelen svetla SF; Zelen kysela 5; Benzenemethanaminium,N-ethyl-N-[4-[[4-[ethyl[(3-sulfophenyl)methyl]amino]phenyl](4-sulfophenyl)methylene]-2,5-cyclohexadien-1-ylidene]-3-sulfo-, inner salt, disodiumsalt; Sodium 3-((-ethyl(-4-((4-(ethyl(3-sulfonatobenzyl)amino)phenyl)(4-sulfonatophenyl)methylene)cyclohexa-2,5-dien-1-ylidene)ammonio)methyl)benzenesulfonate; sodium 3-((ethyl((1E,4E)-4-((4-(ethyl(3-sulfonatobenzyl)amino)phenyl)(4-sulfonatophenyl)methylene)cyclohexa-2,5-dien-1-ylidene)ammonio)methyl)benzenesulfonate; Zelen potravinarska 2 [Czech]; Zelen potravinarska 2; EINECS 225-906-5; FD&C Green No. 2 - Aluminum Lake; FD & C green no. 2; Light Green SF, Yellowish, pure, high purity biological stain; HSDB 8009; Acid Green GG; Guinea Green 2G; Benzenemethanaminium, N-ethyl-N-(4-((4-(ethyl((3-sulfophenyl)methyl)amino)phenyl)(4-sulfophenyl)methylene)-2,5-cyclohexadien-1-ylidene)-3-sulfo-, inner salt, sodium salt (1:2); Benzenemethanaminium, N-ethyl-N-[4-[[4-[ethyl[(3-sulfophenyl)methyl]amino]phenyl](4-sulfophenyl)methylene]-2,5-cyclohexadien-1-ylidene]-3-sulfo-, inner salt, sodium salt (1:2); light green SF, yellowish; Benzenemethanaminium, N-ethyl-N-(4-((4-(ethyl((3-sulfophenyl)methyl)amino)phenyl)(4-sulfophenyl)methylene)-2,5-cyclohexadien-1-ylidene)-3-sulfo-, hydroxide, inner salt, disodium salt; SCHEMBL333260; DTXSID8020672; C37H34N2O9S3.2Na; CHEBI:87065; AKOS015902760; AKOS025310847; DB11183; Ammonium, ethyl(4-(p-(ethyl(m-sulfobenzyl)amino)-alpha-(p-sulfophenyl)benzylidene)-2,5-cyclohexadien-1-ylidene)(m-sulfobenzyl)-, hydroxide, inner salt, disodium salt; Benzenemethanaminium, N-ethyl-N-(4-((4-(ethyl((3-sulfophenyl)methyl)amino)phenyl)(4-sulfophenyl)methy lene)-2,5-cyclohexadien-1-ylidene)-3-sulfo-, hydroxide, inner salt, disodium salt; Benzenemethanaminium, N-ethyl-N-(4-((4-(ethyl((3-sulfophenyl)methyl)amino)phenyl)(4-sulfophenyl)methylene)-2,5-cyclohexadien-1-ylidene)-3-sulfo-, inner salt, disodium salt; Dihydrogen (ethyl)(4-(p-(ethyl(m-sulphonatobenzyl)amino)-p'-sulphonatobenzhydrylene)cyclohexa-2,5-dien-1-ylidene)(m-sulphonatobenzyl)ammonium, disodium salt; disodium 3-[(ethyl{(1Z,4Z)-4-[(4-{ethyl[(3-sulfonatophenyl)methyl]amino}phenyl)(4-sulfonatophenyl)methylidene]cyclohexa-2,5-dien-1-ylidene}ammonio)methyl]benzenesulfonate; T099; C.I. Acid Green 5, disodium salt (8CI); Light Green SF Yellowish (C.I. 42095); FT-0627852; L0054; L0141; Q6546012; Benzenemethanaminium, N-ethyl-N-(4-((4-(ethyl((3-sulfophenyl)methyl)amino)phenyl)(4-sulfophenyl)methylene)-2,5-cyclohexadien-1-ylidene)-3-sulfo-, hydroxide, inner salt, disodium salt (9CI); disodium 3-[(ethyl{4-[(4-{ethyl[(3-sulfonatophenyl)methyl]amino}phenyl)(4-sulfonatophenyl)methylidene]cyclohexa-2,5-dien-1-ylidene}azaniumyl)methyl]benzene-1-sulfonate; sodium 3-(((E)-ethyl((E)-4-((4-(ethyl(3-sulfonatobenzyl)amino)phenyl)(4-sulfonatophenyl)methylene)cyclohexa-2,5-dienylidene)ammonio)methyl)benzenesulfonate
DIG Function
Colorant
PubChem CID
21223
Formula
C37H34N2Na2O9S3
Canonical SMILES
CCN(CC1=CC(=CC=C1)S(=O)(=O)[O-])C2=CC=C(C=C2)C(=C3C=CC(=[N+](CC)CC4=CC(=CC=C4)S(=O)(=O)[O-])C=C3)C5=CC=C(C=C5)S(=O)(=O)[O-].[Na+].[Na+]
InChI
1S/C37H36N2O9S3.2Na/c1-3-38(25-27-7-5-9-35(23-27)50(43,44)45)32-17-11-29(12-18-32)37(31-15-21-34(22-16-31)49(40,41)42)30-13-19-33(20-14-30)39(4-2)26-28-8-6-10-36(24-28)51(46,47)48;;/h5-24H,3-4,25-26H2,1-2H3,(H2-,40,41,42,43,44,45,46,47,48);;/q;2*+1/p-2
InChIKey
DGOBMKYRQHEFGQ-UHFFFAOYSA-L
   Click to Show/Hide the Molecular Data (Structure/Property) of This DIG
Structure
<iframe style="width: 300px; height: 300px;" frameborder="0" src="https://embed.molview.org/v1/?mode=balls&cid=21223"></iframe>
3D MOL is not available 2D MOL
Physicochemical Properties Molecular Weight 792.9 Topological Polar Surface Area 203
XlogP N.A. Complexity 1500
Heavy Atom Count 53 Rotatable Bond Count 9
Hydrogen Bond Donor Count 0 Hydrogen Bond Acceptor Count 10
Full List of Biological Targets of DIG (DBTs) Regulated by This DIG
      Potential-driven transporter (PDT)
            DBT Name: Solute carrier SLCO2B1 (OATPB) Click to Show/Hide
               Detailed Information DBT Info click to show the detail info of this DBT
               Experiment for Assessing the Biological Activity of the Studied DIG on This DBT
                    Biological Activity Ki = 0.7 M (tested by experiment) [1]
                    Tested Species Homo sapiens (Human)
                    UniProt ID SO2B1_HUMAN
References
1 The activities of drug inactive ingredients on biological targets. Science. 2020 Jul 24;369(6502):403-413.

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