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Substance Name: PA 626
RN: 187235-24-1
InChIKey: XLBGKFOPSLICIW-GUNGLEHYSA-N

Molecular Formula

  • C16-H23-N3-O4

Molecular Weight

  • 321.3747
 
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Names and Synonyms

Results Name

  • PA 626

Synonym

  • PA-626

Systematic Name

  • (S)-6-((E)-3,7-Dimethyl-octa-2,6-dienyloxy)-2-nitro-6,7-dihydro-5H-imidazo(2,1-b)(1,3)oxazine

Registry Numbers

CAS Registry Number

  • 187235-24-1

System Generated Number

  • 0187235241

Structure Descriptors

InChI

1S/C16H23N3O4/c1-12(2)5-4-6-13(3)7-8-22-14-9-18-10-15(19(20)21)17-16(18)23-11-14/h5,7,10,14H,4,6,8-9,11H2,1-3H3/b13-7+/t14-/m0/s1

InChIKey

XLBGKFOPSLICIW-GUNGLEHYSA-N

Smiles

CC(=CCC/C(=C/CO[C@H]1Cn2cc(nc2OC1)[N+](=O)[O-])/C)C