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Substance Name: Rupicolin B
RN: 41653-83-2
InChIKey: ZDBHCMLPJQZVAX-IHWVXMPCSA-N

Note

  • Fron Achillea setacea.

Molecular Formula

  • C15-H18-O4

Molecular Weight

  • 262.3032
 
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Names and Synonyms

Name of Substance

  • Rupicolin B

Systematic Name

  • Azuleno(4,5-b)furan-2(3H)-one, 3a,4,5,6,6a,7,9a,9b-octahydro-4,6a-dihydroxy-9-methyl-3,6-bis(methylene)-, (3aR-(3aalpha,4alpha,6aalpha,9aalpha,9bbeta))-

Registry Numbers

CAS Registry Number

  • 41653-83-2

System Generated Number

  • 0041653832

Structure Descriptors

InChI

1S/C15H18O4/c1-7-4-5-15(18)8(2)6-10(16)11-9(3)14(17)19-13(11)12(7)15/h4,10-13,16,18H,2-3,5-6H2,1H3/t10-,11+,12+,13-,15+/m0/s1

InChIKey

ZDBHCMLPJQZVAX-IHWVXMPCSA-N

Smiles

CC1=CC[C@@]2([C@H]1[C@@H]3[C@@H]([C@H](CC2=C)O)C(=C)C(=O)O3)O