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Substance Name: 17,19-Dinoratis-15-ene-4,13,14-tricarboxylic acid, 16-(1-methylethyl)-, sodium salt (1:2), (4alpha,8alpha,12alpha,13R,14R)-
RN: 63179-62-4
InChIKey: FNCJMFZFEUMANB-WDGKIORXSA-N

Molecular Formula

  • C24-H34-O6.2Na

Molecular Weight

  • 464.5066
 
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Names and Synonyms

Synonym

  • EINECS 263-984-2

Systematic Names

  • (4alpha,8alpha,12alpha,13R,14R)-16-Isopropyl-17,19-dinoratis-15-ene-4,13,14-tricarboxylic acid, disodium salt
  • 17,19-Dinoratis-15-ene-4,13,14-tricarboxylic acid, 16-(1-methylethyl)-, disodium salt, (4alpha,8alpha,12alpha,13R,14R)-
  • 17,19-Dinoratis-15-ene-4,13,14-tricarboxylic acid, 16-(1-methylethyl)-, sodium salt (1:2), (4alpha,8alpha,12alpha,13R,14R)-

Registry Numbers

CAS Registry Number

  • 63179-62-4

System Generated Number

  • 0063179624

Molecular Formulas

Molecular Formula

  • C24-H34-O6.2Na

Molecular Formula Fragments

  • C24-H34-O6
  • COMPONENT
  • Na

Structure Descriptors

InChI

1S/C24H34O6.2Na/c1-12(2)14-11-24-9-6-15-22(3,7-5-8-23(15,4)21(29)30)16(24)10-13(14)17(19(25)26)18(24)20(27)28;;/h11-13,15-18H,5-10H2,1-4H3,(H,25,26)(H,27,28)(H,29,30);;/q;2*+1/t13-,15+,16+,17+,18-,22-,23+,24-;;/m0../s1

InChIKey

FNCJMFZFEUMANB-WDGKIORXSA-N

Smiles

CC(C)C1=C[C@@]23CC[C@@H]4[C@@]([C@H]2C[C@@H]1[C@H]([C@H]3C(=O)O)C(=O)O)(CCC[C@@]4(C)C(=O)O)C.[Na+].[Na+]