Coprogen

CAS Registry Number®

31418-71-0

CAS Name

Coprogen

Molecular Formula

C35H53FeN6O13

Cite this Page

Coprogen.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=31418-71-0 (retrieved 2024-11-22) (CAS RN: 31418-71-0).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C35H53N6O13.Fe/c1-23(11-17-42)20-30(45)39(51)14-5-8-27-33(48)38-28(34(49)37-27)9-6-15-40(52)32(47)22-25(3)13-19-54-35(50)29(36-26(4)44)10-7-16-41(53)31(46)21-24(2)12-18-43;/h20-22,27-29,42-43H,5-19H2,1-4H3,(H,36,44)(H,37,49)(H,38,48);/q-3;+3

InChIKey

InChIKey=FQIVLXIUJLOKPL-UHFFFAOYSA-N

SMILES

C(=C(CCO)C)C1=O[Fe+3]2345O=C(N([O-]2)CCCC6C(=O)NC(CCCN1[O-]3)C(=O)N6)C=C(C)CCOC(=O)C(NC(C)=O)CCCN([O-]4)C(C=C(CCO)C)=O5

Canonical SMILES

O=C1OCCC(=CC2=O[Fe+3]345(O=C(C=C(C)CCO)N([O-]3)CCCC1NC(=O)C)O=C(C=C(C)CCO)N([O-]4)CCCC6NC(=O)C(NC6=O)CCCN2[O-]5)C

Other Names for this Substance

  • Iron, [(3E)-5-[(hydroxy-κO)[3-[(2S,5S)-5-[3-[(hydroxy-κO)[(2E)-5-hydroxy-3-methyl-1-(oxo-κO)-2-penten-1-yl]amino]propyl]-3,6-dioxo-2-piperazinyl]propyl]amino]-3-methyl-5-(oxo-κO)-3-penten-1-yl N2-acetyl-N5-(hydroxy-κO)-N5-[(2E)-5-hydroxy-3-methyl-1-(oxo-κO)-2-penten-1-yl]-L-ornithinato(3-)]-
  • 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 N2-acetyl-N5-hydroxy-N5-(5-hydroxy-3-methyl-1-oxo-2-pentenyl)-L-ornithinato(3-)]-
  • Iron, [[N2-acetyl-N5-hydroxy-N5-(5-hydroxy-3-methyl-2-pentenoyl)ornithine monoester with N,N′-[(3,6-dioxo-2,5-piperazinediyl)bis(trimethylene)]bis[5-hydroxy-3-methyl-2-pentenohydroxamic acid]]ato(3-)]-
  • Iron, [5-[(hydroxy-κO)[3-[5-[3-[(hydroxy-κO)[5-hydroxy-3-methyl-1-(oxo-κO)-2-pentenyl]amino]propyl]-3,6-dioxo-2-piperazinyl]propyl]amino]-3-methyl-5-(oxo-κO)-3-pentenyl N2-acetyl-N5-(hydroxy-κO)-N5-[5-hydroxy-3-methyl-1-(oxo-κO)-2-pentenyl]-L-ornithinato(3-)]-
  • L-Ornithine, N2-acetyl-N5-hydroxy-N5-(5-hydroxy-3-methyl-1-oxo-2-pentenyl)-, 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 ester, iron complex

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Deleted or Replaced CAS Registry Numbers

1391-13-5, 11103-99-4, 30853-52-2

CAS INSIGHTSTM
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