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coprogen

Properties

Image

Occurences in reactions

MNX_ID

MNXM726881

	#reac
in my sandbox	0
in MNXref (generic)	6
in models (compartimentalized)	0

formula

C₃₅H₅₆FeN₆O₁₃

charge

mass

824.32383

reference

seedM:cpd15437

InChIKey

CNQOFHQPFCWVMD-DWZMLRRXSA-N

InChI

InChI=1S/C35H56N6O13.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;/h20-22,27-29,42-43,51-53H,5-19H2,1-4H3,(H,36,44)(H,37,49)(H,38,48);/q;+3/b23-20+,24-21+,25-22+;/t27-,28-,29-;/m0./s1

SMILES

CC(=O)N[C@@H](CCCN(O)C(=O)/C=C(\C)CCO)C(=O)OCC/C(C)=C/C(=O)N(O)CCC[C@@H]1NC(=O)[C@H](CCCN(O)C(=O)/C=C(\C)CCO)NC1=O.[Fe+3]

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
seed.compound:cpd15437 seedM:cpd15437	coprogen cpgn ferric coprogen
seedM:M_cpd15437	secondary/obsolete/fantasy identifier