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Substance Name: N(alpha)-Dimethylcoprogen
RN: 117892-97-4
InChIKey: JDHISTLPUACCFK-IYMJAPOQSA-N

Note

  • Siderophore isolated from Alternaria longipes.

Molecular Formula

  • C35-H55-Fe-N6-O12

Molecular Weight

  • 807.6945
 
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Names and Synonyms

Name of Substance

  • N(alpha)-Dimethylcoprogen

Synonym

  • (5-(Hydroxy(3-(5-(3-(hydroxy(5-hydroxy-3-methyl-1-oxo-2-pentenyl)amino)propyl)-3,6-dioxo-2-piperazinyl)propyl)amino)-3-methyl-5-oxo-3-pentenyl N5-hydroxy-N5-(5-hydroxy-3-methyl-1-oxo-2-pentenyl)-N2,N2-dimethyl-L-ornithionato(3-))iron

Systematic Name

  • Iron, (5-(hydroxy(3-(5-(3-(hydroxy(5-hydroxy-3-methyl-1-oxo-2-pentenyl)amino)propyl)-3,6-dioxo-2-piperazinyl)propyl)amino)-3-methyl-5-oxo-3-pentenyl N5-hydroxy-N5-(5-hydroxy-3-methyl-1-oxo-2-pentenyl)-N2,N2-dimethyl-L-ornithionato(3-))-

Registry Numbers

CAS Registry Number

  • 117892-97-4

System Generated Number

  • 0117892974

Structure Descriptors

InChI

1S/C35H55N6O12.Fe/c1-24(12-18-42)21-30(44)39(50)15-6-9-27-33(47)37-28(34(48)36-27)10-7-16-40(51)32(46)23-26(3)14-20-53-35(49)29(38(4)5)11-8-17-41(52)31(45)22-25(2)13-19-43;/h21-23,27-29,42-43H,6-20H2,1-5H3,(H,36,48)(H,37,47);/q-3;+3/b24-21-,25-22+,26-23-;

InChIKey

JDHISTLPUACCFK-IYMJAPOQSA-N

Smiles

C/C(=C/C(=O)N(CCCC1C(=O)NC(C(=O)N1)CCCN(C(=O)/C=C(/C)\CCOC(=O)C(CCCN(C(=O)/C=C(\C)/CCO)[O-])N(C)C)[O-])[O-])/CCO.[Fe+3]