Sodium 2-((dodecyloxy)carbonyl)-4-sulfonatobenzoate

Catalog No. :
ACZCQK597
CAS No. :
6879-45-4
Molecular Formula :
C20H28Na2O7S
Molecular Weight :
458.48

IUPAC Name:sodium 2-((dodecyloxy)carbonyl)-4-sulfonatobenzoate

Sodium 2-((dodecyloxy)carbonyl)-4-sulfonatobenzoate structure diagram
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Product Information

Product NameSodium 2-((dodecyloxy)carbonyl)-4-sulfonatobenzoate
IUPAC Namesodium 2-((dodecyloxy)carbonyl)-4-sulfonatobenzoate
Molecular FormulaC20H28Na2O7S
Molecular Weight458.48
SMILESCCCCCCCCCCCCOC(=O)C1=CC(S(=O)(=O)[O-])=CC=C1C(=O)[O-].[Na+].[Na+]
InChI KeyFKUITBKKFLKVMS-UHFFFAOYSA-L
Synonym3,7,12,23-tetrahydroxycholan-24-oic acid;alpha-Phocaecholic acid;(2R,4R)-2-hydroxy-4-[(3R,5S,7R,8R,9S,10S,12S,13R,14S,17R)-3,7,12-trihydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoic acid;Cholan-24-oic acid, 3,7,12,23-tetrahydroxy-, (3α,5β,7α,12α,23R)- (9CI);3α,7α,12α,23R-tetrahydroxy-5β-cholan-24-oic acid
CAS No.6879-45-4

Synthetic Route by SureRoute

1. ACZCQK597 Molecular Building Block Synthetic Route

Source: SureRouteAuthor: aifchem

  1. reactant_1 route compound structure diagram
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  5. ACZCQK597 route product structure diagram
    ACZCQK5976879-45-4
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2. ACZCQK597 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. ACZCQK597 route product structure diagram
    ACZCQK5976879-45-4
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