calcium 2-amino-5-((4-amino-3-sulfonatophenyl)(4-imino-3-sulfonatocyclohexa-2,5-dien-1-ylidene)methyl)-3-methylbenzenesulfonate

Catalog No. :
ACEMXJ387
CAS No. :
123334-10-1
Molecular Formula :
C40H32Ca3N6O18S6
Molecular Weight :
1197.36

IUPAC Name:calcium 2-amino-5-((4-amino-3-sulfonatophenyl)(4-imino-3-sulfonatocyclohexa-2,5-dien-1-ylidene)methyl)-3-methylbenzenesulfonate

calcium 2-amino-5-((4-amino-3-sulfonatophenyl)(4-imino-3-sulfonatocyclohexa-2,5-dien-1-ylidene)methyl)-3-methylbenzenesulfonate structure diagram
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Product Information

Product Namecalcium 2-amino-5-((4-amino-3-sulfonatophenyl)(4-imino-3-sulfonatocyclohexa-2,5-dien-1-ylidene)methyl)-3-methylbenzenesulfonate
IUPAC Namecalcium 2-amino-5-((4-amino-3-sulfonatophenyl)(4-imino-3-sulfonatocyclohexa-2,5-dien-1-ylidene)methyl)-3-methylbenzenesulfonate
MDL No.MFCD00001654
Molecular FormulaC40H32Ca3N6O18S6
Molecular Weight1197.36
SMILESCC1=C(N)C(S(=O)(=O)[O-])=CC(C(=C2C=CC(=N)C(S(=O)(=O)[O-])=C2)C2=CC=C(N)C(S(=O)(=O)[O-])=C2)=C1.CC1=C(N)C(S(=O)(=O)[O-])=CC(C(=C2C=CC(=N)C(S(=O)(=O)[O-])=C2)C2=CC=C(N)C(S(=O)(=O)[O-])=C2)=C1.[Ca+2].[Ca+2].[Ca+2]
InChI KeyUQRRBOCJYCHOQR-UHFFFAOYSA-H
SynonymDTXSID50924469 | Acid magenta | Acid Fuchsin calcium salt | J-004922 | Acid rubin | Calcium 3,3'-[(4-imino-3-methyl-5-sulfocyclohexa-2,5-dien-1-ylidene)methylene]bis(6-aminobenzene-1-sulfonate) | AKOS025294211 | calcium;2-amino-5-[(4-amino-3-sulfonatophen
CAS No.123334-10-1
PubChem CID16218605

Synthetic Route by SureRoute

1. ACEMXJ387 Molecular Building Block Synthetic Route

Source: SureRouteAuthor: aifchem

  1. reactant_1 route compound structure diagram
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  2. Plus
  3. reactant_2 route compound structure diagram
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  4. Then
  5. ACEMXJ387 route product structure diagram
    ACEMXJ387123334-10-1
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2. ACEMXJ387 Molecular Building Block Synthetic Route

Source: SureRouteAuthor: aifchem

  1. reactant_1 route compound structure diagram
    --
  2. Then
  3. ACEMXJ387 route product structure diagram
    ACEMXJ387123334-10-1
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