sodium (4bS,8R,8aR)-8-carboxy-2-isopropyl-4b,8-dimethyl-4b,5,6,7,8,8a,9,10-octahydrophenanthrene-3-sulfonate pentahydrate

Catalog No. :
ACDZOB574
CAS No. :
219773-47-4
Molecular Formula :
C20H37NaO10S
Molecular Weight :
492.56

IUPAC Name:sodium (4bS,8R,8aR)-8-carboxy-2-isopropyl-4b,8-dimethyl-4b,5,6,7,8,8a,9,10-octahydrophenanthrene-3-sulfonate pentahydrate

sodium (4bS,8R,8aR)-8-carboxy-2-isopropyl-4b,8-dimethyl-4b,5,6,7,8,8a,9,10-octahydrophenanthrene-3-sulfonate pentahydrate structure diagram
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Product Information

Product Namesodium (4bS,8R,8aR)-8-carboxy-2-isopropyl-4b,8-dimethyl-4b,5,6,7,8,8a,9,10-octahydrophenanthrene-3-sulfonate pentahydrate
IUPAC Namesodium (4bS,8R,8aR)-8-carboxy-2-isopropyl-4b,8-dimethyl-4b,5,6,7,8,8a,9,10-octahydrophenanthrene-3-sulfonate pentahydrate
MDL No.MFCD28009632
Molecular FormulaC20H37NaO10S
Molecular Weight492.56
SMILESCC(C)C1=C(S(=O)(=O)[O-])C=C2C(=C1)CC[C@H]1[C@](C)(C(=O)O)CCC[C@]21C.O.O.O.O.O.[Na+]
InChI KeyOWUMMAIYWPECON-HITVYADUSA-M
SynonymEcabet sodium pentahydrate | DTXSID00176390 | ECABET SODIUM PENTAHYDRATE [WHO-DD] | Ecabetsodiumpentahydrate | 1-Phenanthrenecarboxylic acid, 1,2,3,4,4a,9,10,10a-octahydro-1,4a-dimethyl-7-(1-methylethyl)-6-sulfo-, monosodium salt, pentahydrate, (1R,4aS,10
CAS No.219773-47-4
PubChem CID24892838

Safety Data

Pictogram
Harmful or irritant
Signal Word
Warning
Hazard Statement(s)
H302-H315-H319-H332-H335
Precautionary Statement(s)
P261-P280-P305+P351+P338

Synthetic Route by SureRoute

1. ACDZOB574 Molecular Building Block Synthetic Route

Source: SureRouteAuthor: aifchem

  1. reactant_1 route compound structure diagram
    --
  2. Then
  3. ACDZOB574 route product structure diagram
    ACDZOB574219773-47-4
Inquiry

2. ACDZOB574 Molecular Building Block Synthetic Route

Source: SureRouteAuthor: aifchem

  1. reactant_1 route compound structure diagram
    --
  2. Then
  3. ACDZOB574 route product structure diagram
    ACDZOB574219773-47-4
Inquiry

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