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Substance Name: Gracilin C
RN: 106621-85-6
InChIKey: LJWUZALDGBNRAU-QXXFJAJFSA-N

Molecular Weight

  • 420.455
 
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Names and Synonyms

Results Name

  • Gracilin C

Synonyms

  • BE-Gracilin B
  • Gracilin C

Systematic Name

  • Difuro(2,3-b:3',2'-d)furan-2(3H)-one, 4,5-bis(acetyloxy)-3-((3,3-dimethylcyclohexylidene)ethylidene)hexahydro-,(3aS-(3E(E),3aalpha,3balpha,4alpha,5beta,6aalpha,7aalpha))-

Registry Numbers

CAS Registry Number

  • 106621-85-6

System Generated Number

  • 0106621856

Structure Descriptors

InChI

1S/C22H28O8/c1-11(23)26-17-16-15-14(8-7-13-6-5-9-22(3,4)10-13)18(25)28-19(15)29-20(16)30-21(17)27-12(2)24/h7-8,15-17,19-21H,5-6,9-10H2,1-4H3/b13-7-,14-8+/t15-,16-,17-,19+,20+,21-/m1/s1

InChIKey

LJWUZALDGBNRAU-QXXFJAJFSA-N

Smiles

O1[C@H]2[C@@H]([C@H]3[C@@H]1O[C@H]([C@@H]3OC(=O)C)OC(=O)C)C(\C(O2)=O)=C\C=C1/CC(CCC1)(C)C