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Substance Name: Jodrellin B
RN: 124901-81-1
InChIKey: LRQDGRZQEBZSRI-UHFFFAOYSA-N

Molecular Formula

  • C26-H36-O8

Molecular Weight

  • 476.562
 
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Names and Synonyms

Results Name

  • Jodrellin B

Synonym

  • Jodrellin B

Systematic Name

  • Caryoptinol, O18-deacetyl-3-deoxy-2,18-epoxy-O18-(2-methyl-1-oxopropoxy)-, (2alpha,18R)-

Registry Numbers

CAS Registry Number

  • 124901-81-1

System Generated Number

  • 0124901811

Structure Descriptors

InChI

1S/C26H36O8/c1-13(2)21(28)34-23-26-11-25(12-30-25)19(33-23)10-17(26)24(5,14(3)8-20(26)31-15(4)27)18-9-16-6-7-29-22(16)32-18/h6-7,13-14,16-20,22-23H,8-12H2,1-5H3

InChIKey

LRQDGRZQEBZSRI-UHFFFAOYSA-N

Smiles

C(C(C)C)(=O)O[C@@H]1[C@@]23[C@@H](C[C@@H](O1)[C@@]1(C3)OC1)[C@@]([C@@H](C[C@@H]2OC(=O)C)C)([C@@H]1C[C@@H]2[C@@H](O1)OC=C2)C