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Concept information

Preferred term

palladium(ii) octaethylporphyrinketone  

Type

  • http://www.irandoc.ac.ir/onto/irandoc-meta/Concept

Broader concept

charge

  • 0

formula

  • C36H46N4OPd

has_role

inchi

  • InChI=1S/C36H45N4O.Pd/c1-9-21-22(10-2)28-18-30-25(13-5)26(14-6)32(39-30)20-34-36(15-7,16-8)35(41)33(40-34)19-31-24(12-4)23(11-3)29(38-31)17-27(21)37-28;/h17-20H,9-16H2,1-8H3,(H-,37,38,39,40,41);/q-1;+2/p-1

inchikey

  • DPIOVSWGZKCUKE-UHFFFAOYSA-M

mass

  • 657.193

monoisotopicmass

  • 654.25499

smiles

  • C=1C=2C(=C(C=3N2[Pd]45N=6C(=CC=7N4C(C3)=C(C7CC)CC)C(C(C6C=C8N5C1C(=C8CC)CC)=O)(CC)CC)CC)CC

subset

  • 3_STAR

synonym EXACT

  • (3,3,7,8,12,13,17,18-octaethylporphyrin-2(3H)-one-kappa(4)N(21),N(22),N(23),N(24))palladium

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:52199

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