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Substance Name: Psammaplin A
RN: 110659-91-1
InChIKey: LMAFSGDNHVBIHU-XUIWWLCJSA-N

Note

  • Isolated from marine sponges Poecillastra and Jaspis.

Molecular Formula

  • C22-H24-Br2-N4-O6-S2

Molecular Weight

  • 664.394
 
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Names and Synonyms

Name of Substance

  • Psammaplin A

Systematic Name

  • Benzenepropanamide, N,N'-(dithiodi-2,1-ethanediyl)bis(3-bromo-4-hydroxy-alpha-(hydroxyimino)-

Registry Numbers

CAS Registry Number

  • 110659-91-1

System Generated Number

  • 0110659911

Structure Descriptors

InChI

1S/C22H24Br2N4O6S2/c23-15-9-13(1-3-19(15)29)11-17(27-33)21(31)25-5-7-35-36-8-6-26-22(32)18(28-34)12-14-2-4-20(30)16(24)10-14/h1-4,9-10,29-30,33-34H,5-8,11-12H2,(H,25,31)(H,26,32)/b27-17+,28-18+

InChIKey

LMAFSGDNHVBIHU-XUIWWLCJSA-N

Smiles

S(SCCNC(\C(Cc1cc(c(cc1)O)Br)=N\O)=O)CCNC(\C(Cc1cc(c(cc1)O)Br)=N\O)=O