[2-(hydroxy-kappao)-4-[(3-{(hydroxy-kappao)[1-(hydroxy-kappao)ethenyl]amino}propyl)amino]-2-{2-[(3-{(hydroxy-kappao)[1-(hydroxy-kappao)ethenyl]amino}propyl)amino]-2-oxoethyl}-4-oxobutanoato(6-)-kappao]iron (Q27465393)

[2-(Hydroxy-kappaO)-4-[(3-{(hydroxy-kappaO)[1-(hydroxy-kappaO)vinyl]amino}propyl)amino]-2-{2-[(3-{(hydroxy-kappaO)[1-(hydroxy-kappaO)vinyl]amino}propyl)amino]-2-oxoethyl}-4-oxobutanoato(6-)-kappaO]iro (English)

retrieved

19 October 2016

chemical formula

C₁₆H₂₂FeN₄O₉

1 reference

based on heuristic

inferred from SMILES

canonical SMILES

C=C1N2CCCNC(=O)CC34CC(=O)NCCCN5C(=C)O[Fe](O1)(O3)(O2)(O5)OC4=O

1 reference

InChI=1S/C16H25N4O9.Fe/c1-11(21)19(28)7-3-5-17-13(23)9-16(27,15(25)26)10-14(24)18-6-4-8-20(29)12(2)22;/h21-22H,1-10H2,(H,17,23)(H,18,24)(H,25,26);/q-3;+6/p-3

[2-(Hydroxy-kappaO)-4-[(3-{(hydroxy-kappaO)[1-(hydroxy-kappaO)vinyl]amino}propyl)amino]-2-{2-[(3-{(hydroxy-kappaO)[1-(hydroxy-kappaO)vinyl]amino}propyl)amino]-2-oxoethyl}-4-oxobutanoato(6-)-kappaO]iro (English)

retrieved

19 October 2016

Identifiers

InChI

1 reference

KGGQZTFRTARRPX-UHFFFAOYSA-K

[2-(Hydroxy-kappaO)-4-[(3-{(hydroxy-kappaO)[1-(hydroxy-kappaO)vinyl]amino}propyl)amino]-2-{2-[(3-{(hydroxy-kappaO)[1-(hydroxy-kappaO)vinyl]amino}propyl)amino]-2-oxoethyl}-4-oxobutanoato(6-)-kappaO]iro (English)

retrieved

19 October 2016

InChIKey

1 reference

[2-(Hydroxy-kappaO)-4-[(3-{(hydroxy-kappaO)[1-(hydroxy-kappaO)vinyl]amino}propyl)amino]-2-{2-[(3-{(hydroxy-kappaO)[1-(hydroxy-kappaO)vinyl]amino}propyl)amino]-2-oxoethyl}-4-oxobutanoato(6-)-kappaO]iro (English)

19 October 2016

1 reference

[2-(Hydroxy-kappaO)-4-[(3-{(hydroxy-kappaO)[1-(hydroxy-kappaO)vinyl]amino}propyl)amino]-2-{2-[(3-{(hydroxy-kappaO)[1-(hydroxy-kappaO)vinyl]amino}propyl)amino]-2-oxoethyl}-4-oxobutanoato(6-)-kappaO]iro (English)

19 October 2016

1 reference