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Substance Name: Isohelenalin
RN: 479-09-4
InChIKey: MXDBSOSHFBRRIJ-JMLQNSIWSA-N

Molecular Weight

  • 262.303
 
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Names and Synonyms

Name of Substance

  • Isohelenalin

Systematic Name

  • Azuleno(6,5-b)furan-2,5-dione, 4,4a,7a,8,9,9a-hexahydro-4-hydroxy-3,4a,8-trimethyl-, (4S-(4alpha,4abeta,7aalpha,8alpha,9aalpha))-

Registry Numbers

CAS Registry Number

  • 479-09-4

System Generated Number

  • 0000479094

Structure Descriptors

InChI

1S/C15H18O4/c1-7-6-10-12(8(2)14(18)19-10)13(17)15(3)9(7)4-5-11(15)16/h4-5,7,9-10,13,17H,6H2,1-3H3/t7-,9+,10-,13+,15+/m1/s1

InChIKey

MXDBSOSHFBRRIJ-JMLQNSIWSA-N

Smiles

O1[C@H]2C(=C(C1=O)C)[C@@H]([C@@]1(C(C=C[C@H]1[C@@H](C2)C)=O)C)O