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Substance Name: GBB 1-Z
RN: 104311-70-8
InChIKey: YYFNNPXWRXQUPR-MKMNVTDBSA-N

Note

  • Isolated as a Z/E mixture from sponge Geodia barretti.

Molecular Formula

  • C17-H19-Br-N6-O2

Molecular Weight

  • 419.281
 
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Names and Synonyms

  • (-)-Barettine
  • Barettin
  • GBB 1-Z

Registry Numbers

CAS Registry Number

  • 104311-70-8

Other Registry Number

  • 606933-69-1

System Generated Number

  • 0104311708

Structure Descriptors

InChI

1S/C17H19BrN6O2/c18-10-3-4-11-9(8-22-13(11)7-10)6-14-16(26)23-12(15(25)24-14)2-1-5-21-17(19)20/h3-4,6-8,12,22H,1-2,5H2,(H,23,26)(H,24,25)(H4,19,20,21)/b14-6+

InChIKey

YYFNNPXWRXQUPR-MKMNVTDBSA-N

Smiles

N(C(N)=N)CCC[C@@H]1NC(C(\NC1=O)=C\c1c[nH]c2cc(ccc12)Br)=O