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Substance Name: Ro 317467
RN: 141368-50-5
InChIKey: FPZBNIMUGKBECV-RLWLMLJZSA-N

Molecular Formula

  • C32-H43-Br-N3-O7-P

Molecular Weight

  • 692.5837
 
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Names and Synonyms

Name of Substance

  • Ro 317467

Synonym

  • Ro 31-7467

Systematic Name

  • Phosphinic acid, ((5-bromo-6-hydroxy-1,3-dioxo-1H-benz(de)isoquinolin-2(3H)-yl)methyl)(4-methyl-2-(((2-oxazacyclotridec-3-yl)amino)carbonyl)pentyl)-, (S-(R*,R*))-

Registry Numbers

CAS Registry Number

  • 141368-50-5

System Generated Number

  • 0141368505

Structure Descriptors

InChI

1S/C32H43BrN3O7P/c1-20(2)16-21(29(38)35-26-14-9-7-5-3-4-6-8-10-15-34-30(26)39)18-44(42,43)19-36-31(40)23-13-11-12-22-27(23)24(32(36)41)17-25(33)28(22)37/h11-13,17,20-21,26,37H,3-10,14-16,18-19H2,1-2H3,(H,34,39)(H,35,38)(H,42,43)/t21-,26+/m1/s1

InChIKey

FPZBNIMUGKBECV-RLWLMLJZSA-N

Smiles

CC(C)C[C@H](CP(=O)(CN1C(=O)c2cccc3c2c(cc(c3O)Br)C1=O)O)C(=O)N[C@H]4CCCCCCCCCCNC4=O