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Substance Name: Fusigen
RN: 19624-79-4
InChIKey: KUQNHSOWVDQAOF-BBXZRSJSSA-N

Note

  • A siderochrome found in Aspergillus.

Molecular Formula

  • C33-H51-N6-O12.Fe

Molecular Weight

  • 779.641
 
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Names and Synonyms

Name of Substance

  • Fusigen

Synonym

  • Fusarinine C

Systematic Name

  • 3,15,27-Triamino-7,19,31-trihydroxy-10,22,34-trimethyl-1,13,25-triox-7,19,31-triazacyclohexa- triaconta-9,21,33-triene-2,8,1420,26,32-hexonato- iron (stereoisomer)

Registry Numbers

CAS Registry Number

  • 19624-79-4

System Generated Number

  • 0019624794

Molecular Formulas

Molecular Formula

  • C33-H51-N6-O12.Fe

Molecular Formula Fragments

  • C33-H51-N6-O12
  • COMPONENT
  • Fe

Structure Descriptors

InChI

1S/C33H51N6O12.Fe/c1-22-10-16-49-31(43)25(34)8-5-14-38(47)29(41)20-24(3)12-18-51-33(45)27(36)9-6-15-39(48)30(42)21-23(2)11-17-50-32(44)26(35)7-4-13-37(46)28(40)19-22;/h19-21,25-27H,4-18,34-36H2,1-3H3;/q-3;+3/b22-19-,23-21-,24-20-;

InChIKey

KUQNHSOWVDQAOF-BBXZRSJSSA-N

Smiles

C1([C@@H](CCCN(C(C=C(CCOC([C@@H](CCCN([O-])C(=O)C=C(C)CCOC([C@@H](CCCN(C(C=C(CCO1)C)=O)[O-])N)=O)N)=O)C)=O)[O-])N)=O.[Fe+3]