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Substance Name: Isariin
RN: 10409-85-5
InChIKey: KIJLRIARMCGDJZ-YSWCBTLJSA-N

Note

  • Cyclodepsipeptide from fungus Isaria felina.

Molecular Formula

  • C33-H59-N5-O7

Molecular Weight

  • 637.857
 
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Names and Synonyms

Name of Substance

  • Isariin

Synonyms

  • Isariin B
  • Isariin C
  • Isariin D
  • Isarolide
  • NSC 135015

Systematic Names

  • Isariin (8CI)
  • L-Valine, N-(N-(N-(N-(N-(3-hydroxy-1-oxododecyl)glycyl)-L-valyl)-D-leucyl)-L-alanyl)-, rho-lactone, (R)- (9CI)

Registry Numbers

CAS Registry Number

  • 10409-85-5

System Generated Number

  • 0010409855

Structure Descriptors

InChI

1S/C33H59N5O7/c1-9-10-11-12-13-14-15-16-24-18-26(39)34-19-27(40)37-28(21(4)5)32(43)36-25(17-20(2)3)31(42)35-23(8)30(41)38-29(22(6)7)33(44)45-24/h20-25,28-29H,9-19H2,1-8H3,(H,34,39)(H,35,42)(H,36,43)(H,37,40)(H,38,41)/t23-,24+,25+,28-,29-/m0/s1

InChIKey

KIJLRIARMCGDJZ-YSWCBTLJSA-N

Smiles

C(CCCCCCC[C@@H]1CC(NCC(N[C@@H](C(C)C)C(N[C@H](CC(C)C)C(N[C@H](C(N[C@H](C(O1)=O)C(C)C)=O)C)=O)=O)=O)=O)C