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Substance Name: Isopetasol
RN: 469-67-0
UNII: 3612JYH60G
InChIKey: TVDMUSYVWJLIDK-PSOPSSQASA-N

Molecular Formula

  • C15-H22-O2

Molecular Weight

  • 234.3368
 
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Names and Synonyms

Results Name

  • Isopetasol

Name of Substance

  • Isopetasol

Synonyms

  • (+)-Isopetasol
  • UNII-3612JYH60G

Systematic Name

  • Eremophila-7(11),9-dien-8-one, 3alpha-hydroxy-

Registry Numbers

CAS Registry Number

  • 469-67-0

FDA UNII

  • 3612JYH60G

System Generated Number

  • 0000469670

Structure Descriptors

InChI

1S/C15H22O2/c1-9(2)12-8-15(4)10(3)13(16)6-5-11(15)7-14(12)17/h7,10,13,16H,5-6,8H2,1-4H3/t10-,13+,15+/m0/s1

InChIKey

TVDMUSYVWJLIDK-PSOPSSQASA-N

Smiles

C[C@H]1[C@H](O)CCC2=CC(=O)C(=C(C)C)C[C@]12C