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Substance Name: Sporidesmin D
RN: 18180-71-7
UNII: 051UM88S3X
InChIKey: CKKYQBFKVBEKFR-UYUBTLJZSA-N

Molecular Formula

  • C20-H26-Cl-N3-O6-S2

Molecular Weight

  • 504.0254
 
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Names and Synonyms

Name of Substance

  • Sporidesmin D

Synonyms

  • Sporidesmin D
  • UNII-051UM88S3X

Systematic Name

  • 2H-Pyrazino(1',2':1,5)pyrrolo(2,3-b)indole-1,4(3H,5aH)-dione, 9-chloro-6,10b,11,11a-tetrahydro-10b,11-dihydroxy-7,8-dimethoxy-2,3,6-trimethyl-3,11a-bis(methylthio)-

Registry Numbers

CAS Registry Number

  • 18180-71-7

FDA UNII

  • 051UM88S3X

System Generated Number

  • 0018180717

Structure Descriptors

InChI

1S/C20H26ClN3O6S2/c1-18(31-6)16(26)24-15-19(28,14(25)20(24,32-7)17(27)23(18)3)9-8-10(21)12(29-4)13(30-5)11(9)22(15)2/h8,14-15,25,28H,1-7H3/t14-,15-,18-,19-,20-/m1/s1

InChIKey

CKKYQBFKVBEKFR-UYUBTLJZSA-N

Smiles

COc1c(Cl)cc2c(N(C)[C@@H]3N4C(=O)[C@@](C)(SC)N(C)C(=O)[C@]4(SC)[C@H](O)[C@]23O)c1OC