CHEBI:232359 - meso-tetra(4-sulfonatophenyl)porphine zn(ii)

ChEBI IDCHEBI:232359
ChEBI Namemeso-tetra(4-sulfonatophenyl)porphine zn(ii)
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FormulaC44H28N4O12S4.Zn
Net Charge0
Average Mass998.382
Monoisotopic Mass995.98780
SMILESO=S(=O)(O)c1ccc(-c2c3ccc([n-]3)c(-c3ccc(S(=O)(=O)O)cc3)c3nc(c(-c4ccc(S(=O)(=O)O)cc4)c4ccc([n-]4)c(-c4ccc(S(=O)(=O)O)cc4)c4nc2C=C4)C=C3)cc1.[Zn+2]
InChIInChI=1S/C44H28N4O12S4.Zn/c49-61(50,51)29-9-1-25(2-10-29)41-33-17-19-35(45-33)42(26-3-11-30(12-4-26)62(52,53)54)37-21-23-39(47-37)44(28-7-15-32(16-8-28)64(58,59)60)40-24-22-38(48-40)43(36-20-18-34(41)46-36)27-5-13-31(14-6-27)63(55,56)57;/h1-24H,(H,49,50,51)(H,52,53,54)(H,55,56,57)(H,58,59,60);/q-2;+2/b41-33-,41-34-,42-35-,42-37-,43-36-,43-38-,44-39-,44-40-;
InChIKeyUNJMTFRCJLYPCK-DAJBKUBHSA-N
ChEBI Ontology
Outgoing Relation(s)
meso-tetra(4-sulfonatophenyl)porphine zn(ii) (CHEBI:232359) is a organic molecular entity (CHEBI:50860)
IUPAC Name 
zinc;4-[10,15,20-tris(4-sulfophenyl)porphyrin-22,24-diid-5-yl]benzenesulfonic acid
Citations