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Substance Name: (14-(2-(3-Furyl)ethyl)-8-methylpodocarpan-13-ylidene)methyl hydrogen sulfate compound with N,N-dimethylguanidine (1:1)
RN: 94203-53-9
InChIKey: MUGYGAQKMRBEQJ-ZJSKVYKZSA-O

Note

  • A farnesoid-X-receptor antagonist; isolated from Coscinoderma mathewsi.

Molecular Formula

  • C25-H38-O5-S.C3-H10-N3

Molecular Weight

  • 538.7692
 
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Names and Synonyms

Synonyms

  • NSC 613010
  • Suvanine

Systematic Name

  • (14-(2-(3-Furyl)ethyl)-8-methylpodocarpan-13-ylidene)methyl hydrogen sulfate compound with N,N-dimethylguanidine (1:1)

Registry Numbers

CAS Registry Number

  • 94203-53-9

System Generated Number

  • 0094203539

Molecular Formulas

Molecular Formula

  • C25-H38-O5-S.C3-H10-N3

Molecular Formula Fragments

  • C25-H38-O5-S
  • C3-H10-N3
  • COMPONENT

Structure Descriptors

InChI

1S/C25H38O5S.C3H9N3/c1-23(2)12-5-13-25(4)21(23)10-14-24(3)20(8-6-18-11-15-29-16-18)19(7-9-22(24)25)17-30-31(26,27)28;1-6(2)3(4)5/h11,15-17,20-22H,5-10,12-14H2,1-4H3,(H,26,27,28);1-2H3,(H3,4,5)/p+1/b19-17+;

InChIKey

MUGYGAQKMRBEQJ-ZJSKVYKZSA-O

Smiles

CC1(CCCC2(C1CCC3(C2CC/C(=C\OS(=O)(=O)O)/C3CCc4ccoc4)C)C)C.C[NH+](C)C(=N)N