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CHEBI:221648 - JBIR-83

ChEBI IDCHEBI:221648
ChEBI NameJBIR-83
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FormulaC34H36N10O7S2
Net Charge0
Average Mass760.859
Monoisotopic Mass760.22099
SMILESCc1oc2nc1C(=O)NC(C)c1nc(cs1)C(=O)NC(C)c1nc(c(C)o1)-c1nc(C(N)=O)ccc1-c1nc(cs1)C(=O)NC(C(C)C)C(=O)NC2C
InChIInChI=1S/C34H36N10O7S2/c1-12(2)22-29(48)37-14(4)32-44-24(17(7)51-32)30(49)38-15(5)33-40-20(10-52-33)27(46)36-13(3)31-43-23(16(6)50-31)25-18(8-9-19(39-25)26(35)45)34-41-21(11-53-34)28(47)42-22/h8-15,22H,1-7H3,(H2,35,45)(H,36,46)(H,37,48)(H,38,49)(H,42,47)
InChIKeyAXGXWZOMAVYANF-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Streptomyces (ncbitaxon:1883) - PubMed (20551986)
ChEBI Ontology
Outgoing Relation(s)
JBIR-83 (CHEBI:221648) is a azamacrocycle (CHEBI:52898)
JBIR-83 (CHEBI:221648) is a keratan 6'-sulfate (CHEBI:18331)
IUPAC Name 
9,12,19,23,26-pentamethyl-14,21,28,31-tetraoxo-29-propan-2-yl-10,24-dioxa-17,34-dithia-6,13,20,27,30,35,36,37,38-nonazahexacyclo[30.2.1.18,11.115,18.122,25.02,7]octatriaconta-1(35),2(7),3,5,8,11(38),15,18(37),22,25(36),32-undecaene-5-carboxamide
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