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CHEBI:51215 - zinc octaethylporphyrin

ChEBI IDCHEBI:51215
ChEBI Namezinc octaethylporphyrin
Stars
Last Modified12 December 2008
SubmitterKirill Degtyarenko
DownloadsMolfile
FormulaC36H44N4Zn
Net Charge0
Average Mass598.166
Monoisotopic Mass596.28574
SMILESCCC1=C(CC)C2=[N]3C1=Cc1c(CC)c(CC)c4[n]1[Zn]31[N]3=C(C=c5c(CC)c(CC)c([n]51)=C2)C(CC)=C(CC)C3=C4
InChIInChI=1S/C36H44N4.Zn/c1-9-21-22(10-2)30-18-32-25(13-5)26(14-6)34(39-32)20-36-28(16-8)27(15-7)35(40-36)19-33-24(12-4)23(11-3)31(38-33)17-29(21)37-30;/h17-20H,9-16H2,1-8H3;/q-2;+2/b29-17-,30-18-,31-17-,32-18-,33-19-,34-20-,35-19-,36-20-;
InChIKeyVVUVWOLOUOYXOI-XTPDIVBZSA-N
Roles Classification
Biological Role:
cofactor  An organic molecule or ion (usually a metal ion) that is required by an enzyme for its activity. It may be attached either loosely (coenzyme) or tightly (prosthetic group).
Application:
fluorochrome  A fluorescent dye used to stain biological specimens.
ChEBI Ontology
Outgoing Relation(s)
zinc octaethylporphyrin (CHEBI:51215) has role fluorochrome (CHEBI:51217)
zinc octaethylporphyrin (CHEBI:51215) is a zinc porphyrin (CHEBI:51216)
IUPAC Name 
[2,3,7,8,12,13,17,18-octaethylporphyrinato(2−)-κ4N21,N22,N23,N24]zinc
Synonym  Source
2,3,7,8,12,13,17,18-octaethyl-21H,23H-porphine zinc(II)NIST Chemistry WebBook
Registry NumbersSources
Beilstein:8181299Beilstein
Beilstein:4612711Beilstein
Gmelin:46496Gmelin
CAS:17632-18-7NIST Chemistry WebBook
CAS:17632-18-7ChemIDplus