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Substance Name: N(alpha)-Dimethylisoneocoprogen I
RN: 117852-96-7
InChIKey: BIZDNKJWCYIABN-JDVCJPALSA-N

Note

  • Siderophore isolated from Alternaria longipes.

Molecular Formula

  • C31-H49-Fe-N6-O11

Molecular Weight

  • 737.6041
 
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Names and Synonyms

Name of Substance

  • N(alpha)-Dimethylisoneocoprogen I

Synonym

  • Dminc-I

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-acetyl-N5-hydroxy-N2,N2-dimethyl-L-ornithinato(3-))-

Registry Numbers

CAS Registry Number

  • 117852-96-7

System Generated Number

  • 0117852967

Structure Descriptors

InChI

1S/C31H49N6O11.Fe/c1-21(12-17-38)19-27(40)36(46)15-6-9-24-29(42)33-25(30(43)32-24)10-7-16-37(47)28(41)20-22(2)13-18-48-31(44)26(34(4)5)11-8-14-35(45)23(3)39;/h19-20,24-26,38H,6-18H2,1-5H3,(H,32,43)(H,33,42);/q-3;+3/b21-19-,22-20-;

InChIKey

BIZDNKJWCYIABN-JDVCJPALSA-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)[O-])N(C)C)[O-])[O-])/CCO.[Fe+3]