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Substance Name: Purealidin J
RN: 172723-35-2
InChIKey: NBOVGEUANNHLCZ-DOMZBBRYSA-N

Molecular Formula

  • C15-H17-Br2-N5-O4

Molecular Weight

  • 491.1383
 
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Names and Synonyms

Results Name

  • Purealidin J

Synonyms

  • Pseudoceratine A
  • Purealidin J

Systematic Name

  • (5R,10S)-N-(2-(2-Amino-1H-imidazol-5-yl)ethyl)-7,9-dibromo-10-hydroxy-8-methoxy-1-oxa-2-azaspiro(4.5)deca-2,6,8-triene-3-carboxamide

Registry Numbers

CAS Registry Number

  • 172723-35-2

System Generated Number

  • 0172723352

Structure Descriptors

InChI

1S/C15H17Br2N5O4/c1-25-11-8(16)4-15(12(23)10(11)17)5-9(22-26-15)13(24)19-3-2-7-6-20-14(18)21-7/h4,6,12,23H,2-3,5H2,1H3,(H,19,24)(H3,18,20,21)/t12-,15+/m1/s1

InChIKey

NBOVGEUANNHLCZ-DOMZBBRYSA-N

Smiles

COC1=C(Br)[C@@H](O)[C@@]2(CC(=NO2)C(=O)NCCc3cnc(N)[nH]3)C=C1Br