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Substance Name: Vernodalin
RN: 21871-10-3
InChIKey: ZSXNBLOPYIJLQV-WSVVRNJXSA-N

Molecular Formula

  • C19-H20-O7

Molecular Weight

  • 360.36
 
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Names and Synonyms

Name of Substance

  • Vernodalin

Synonyms

  • 2H-Furo(2,3-f)(2)benzopyran-2,8(3H)-dione, 3abeta,4,5,5a,6,9,9abeta,9balpha-octahydro-4beta-hydroxy-3,9-dimethylene-5abeta-vinyl-, 2-methylenehydracrylate, (+)-
  • Hydracrylic acid, 2-methylene-, ester with 3abeta,4,5,5a,6,9,9abeta,9balpha-octahydro-4beta-hydroxy-3,9-dimethylene-5abeta-vinyl-2H-furo(2,3-f)(2)benzopyran-2,8(3H)-dione, (+)-

Systematic Names

  • 2-Propenoic acid, 2-(hydroxymethyl)-, (3aR,4S,5aR,9aR,9bR)-5a-ethenyldecahydro-3,9-bis(methylene)-2,8-dioxo-2H-furo(2,3-f)(2)benzopyran-4-yl ester
  • 2-Propenoic acid, 2-(hydroxymethyl)-, 5a-ethenyldecahydro-3,9-bis(methylene)-2,8-dioxo-2H-furo(2,3-f)(2)benzopyran-4-yl ester, (3aR-(3aalpha,4alpha,5aalpha,9aalpha,9bbeta))-

Registry Numbers

CAS Registry Number

  • 21871-10-3

Other Registry Number

  • 56064-66-5

System Generated Number

  • 0021871103

Structure Descriptors

InChI

1S/C19H20O7/c1-5-19-6-12(25-16(21)9(2)7-20)13-10(3)18(23)26-15(13)14(19)11(4)17(22)24-8-19/h5,12-15,20H,1-4,6-8H2/t12-,13+,14+,15-,19+/m0/s1

InChIKey

ZSXNBLOPYIJLQV-WSVVRNJXSA-N

Smiles

C(C(=C)CO)(=O)O[C@H]1C[C@@]2([C@H](C(C(OC2)=O)=C)[C@@H]2[C@@H]1C(C(O2)=O)=C)C=C