sodium (4aS,6aS,6bR,8aR,10S,12aR,12bR,14bS)-10-((2-carboxylatobenzoyl)oxy)-2,2,6a,6b,9,9,12a-heptamethyl-1,3,4,5,6,6a,6b,7,8,8a,9,10,11,12,12a,12b,13,14b-octadecahydropicene-4a(2H)-carboxylate

Catalog No. :
ACICCX995
CAS No. :
168770-31-8
Molecular Formula :
C38H50Na2O6
Molecular Weight :
648.79

IUPAC Name:sodium (4aS,6aS,6bR,8aR,10S,12aR,12bR,14bS)-10-((2-carboxylatobenzoyl)oxy)-2,2,6a,6b,9,9,12a-heptamethyl-1,3,4,5,6,6a,6b,7,8,8a,9,10,11,12,12a,12b,13,14b-octadecahydropicene-4a(2H)-carboxylate

sodium (4aS,6aS,6bR,8aR,10S,12aR,12bR,14bS)-10-((2-carboxylatobenzoyl)oxy)-2,2,6a,6b,9,9,12a-heptamethyl-1,3,4,5,6,6a,6b,7,8,8a,9,10,11,12,12a,12b,13,14b-octadecahydropicene-4a(2H)-carboxylate structure diagram
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Product Information

Product Namesodium (4aS,6aS,6bR,8aR,10S,12aR,12bR,14bS)-10-((2-carboxylatobenzoyl)oxy)-2,2,6a,6b,9,9,12a-heptamethyl-1,3,4,5,6,6a,6b,7,8,8a,9,10,11,12,12a,12b,13,14b-octadecahydropicene-4a(2H)-carboxylate
IUPAC Namesodium (4aS,6aS,6bR,8aR,10S,12aR,12bR,14bS)-10-((2-carboxylatobenzoyl)oxy)-2,2,6a,6b,9,9,12a-heptamethyl-1,3,4,5,6,6a,6b,7,8,8a,9,10,11,12,12a,12b,13,14b-octadecahydropicene-4a(2H)-carboxylate
Molecular FormulaC38H50Na2O6
Molecular Weight648.79
SMILESCC1(C)CC[C@]2(C(=O)[O-])CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](OC(=O)C6=CC=CC=C6C(=O)[O-])C(C)(C)[C@@H]5CC[C@]43C)[C@@H]2C1.[Na+].[Na+]
InChI KeyYBXPMGGHNXZAJS-IAYBDFNWSA-L
SynonymOlean-12-en-28-oic acid, 3-[(2-carboxybenzoyl)oxy]-, sodium salt (1:2), (3β)-
CAS No.168770-31-8

Synthetic Route by SureRoute

1. ACICCX995 Molecular Building Block Synthetic Route

Source: SureRouteAuthor: aifchem

  1. reactant_1 route compound structure diagram
    --
  2. Then
  3. ACICCX995 route product structure diagram
    ACICCX995168770-31-8
Inquiry

2. ACICCX995 Molecular Building Block Synthetic Route

Source: SureRouteAuthor: aifchem

  1. reactant_1 route compound structure diagram
    --
  2. Then
  3. ACICCX995 route product structure diagram
    ACICCX995168770-31-8
Inquiry

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