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Substance Name: Baileyolin
RN: 26620-65-5
InChIKey: NOASRRBRAULRFQ-RMKNXTFCSA-N

Note

  • From Baileya multiradiate.

Molecular Formula

  • C20-H26-O6

Molecular Weight

  • 362.419
 
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Names and Synonyms

Name of Substance

  • Baileyolin

Systematic Name

  • 2-Butenoic acid, 2-methyl-, 2,3,3a,4,4a,5,7a,8,9,9a-decahydro-9-hydroxy-3,4a,8-trimethyl-2,5-dioxoazuleno(6,5-b)furan-4-yl ester (VAN)

Registry Numbers

CAS Registry Number

  • 26620-65-5

System Generated Number

  • 0026620655

Structure Descriptors

InChI

1S/C20H26O6/c1-6-9(2)18(23)26-17-14-11(4)19(24)25-16(14)15(22)10(3)12-7-8-13(21)20(12,17)5/h6-8,10-12,14-17,22H,1-5H3/b9-6+

InChIKey

NOASRRBRAULRFQ-RMKNXTFCSA-N

Smiles

C(\C(=C\C)C)(=O)O[C@@H]1[C@@]2(C(C=C[C@@H]2[C@@H]([C@@H]([C@@H]2OC([C@@H]([C@@H]12)C)=O)O)C)=O)C