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Substance Name: Oxysceptrin
RN: 117417-62-6
InChIKey: BCDVBQKLSBGFBQ-UHFFFAOYSA-N

Note

  • Potent actomyosin ATPAse activator; from the Okinawan marine sponge Agelas cf. nemoechinata.

Molecular Weight

  • 636.3066
 
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Names and Synonyms

Name of Substance

  • Oxysceptrin

Systematic Name

  • 1H-Pyrrole-2-carboxamide, N,N'-((3-(2-amino-4,5-dihydro-5-oxo-1H-imidazol-4-yl)-4-(2-amino-1H-imidazol-4-yl)-1,2-cyclobutanediyl)bis(methylene))bis(4-bromo-, (1R-(1alpha,2beta,3alpha,4beta))-

Registry Numbers

CAS Registry Number

  • 117417-62-6

System Generated Number

  • 0117417626

Structure Descriptors

InChI

1S/C22H24Br2N10O3/c23-8-1-12(27-3-8)18(35)29-5-10-11(6-30-19(36)13-2-9(24)4-28-13)16(17-20(37)34-22(26)33-17)15(10)14-7-31-21(25)32-14/h1-4,7,10-11,15-17,27-28H,5-6H2,(H,29,35)(H,30,36)(H3,25,31,32)(H3,26,33,34,37)

InChIKey

BCDVBQKLSBGFBQ-UHFFFAOYSA-N

Smiles

c1c(c[nH]c1C(=O)NCC2C(C(C2c3c[nH]c(n3)N)C4C(=O)NC(=N4)N)CNC(=O)c5cc(c[nH]5)Br)Br