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Substance Name: Isariin B
RN: 80111-95-1
InChIKey: QWBKHPNGPXORRV-UHFFFAOYSA-N

Molecular Formula

  • C30-H53-N5-O7

Molecular Weight

  • 595.777
 
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Names and Synonyms

Results Name

  • Isariin B

Synonym

  • Isariin B

Systematic Name

  • L-Valine, N-(3-hydroxy-1-oxononyl)glycyl-L-valyl-D-leucyl-L-alanyl-, (5->1)-lactone 5

Registry Numbers

CAS Registry Number

  • 80111-95-1

System Generated Number

  • 0080111951

Structure Descriptors

InChI

1S/C30H53N5O7/c1-9-10-11-12-13-21-15-23(36)31-16-24(37)34-25(18(4)5)29(40)33-22(14-17(2)3)28(39)32-20(8)27(38)35-26(19(6)7)30(41)42-21/h17-22,25-26H,9-16H2,1-8H3,(H,31,36)(H,32,39)(H,33,40)(H,34,37)(H,35,38)

InChIKey

QWBKHPNGPXORRV-UHFFFAOYSA-N

Smiles

N1[C@@H](C(=O)N[C@@H](C(=O)N[C@@H](C)C(N[C@@H](C(C)C)C(=O)O[C@@H](CC(NCC1=O)=O)CCCCCC)=O)CC(C)C)C(C)C