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CHEBI:195322 - Aluminum Phthalocyanine tetrasulfate

Default Structure
ChEBI IDCHEBI:195322
ChEBI NameAluminum Phthalocyanine tetrasulfate
Stars
Submitterdoughowe
DownloadsMolfile
FormulaC32H16N8O12S4.H3Al
Net Charge-2
Average Mass862.798
Monoisotopic Mass861.98316
SMILES[AlH3].[H]OS(=O)(=O)c1c([H])c([H])c2c(c1[H])-c1nc-2nc2[n-]c(nc3nc(nc4[n-]c(n1)c1c([H])c([H])c(S(=O)(=O)O[H])c([H])c14)-c1c([H])c([H])c(S(=O)(=O)O[H])c([H])c1-3)c1c([H])c([H])c(S(=O)(=O)O[H])c([H])c21
InChIInChI=1S/C32H16N8O12S4.Al.3H/c41-53(42,43)13-1-5-17-21(9-13)29-33-25(17)37-30-22-10-14(54(44,45)46)2-6-18(22)27(34-30)39-32-24-12-16(56(50,51)52)4-8-20(24)28(36-32)40-31-23-11-15(55(47,48)49)3-7-19(23)26(35-31)38-29;;;;/h1-12H,(H4-2,33,34,35,36,37,38,39,40,41,42,43,44,45,46,47,48,49,50,51,52);;;;/q-2;;;;
InChIKeyPZUXHAALNFKQDN-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
Aluminum Phthalocyanine tetrasulfate (CHEBI:195322) is a organic molecular entity (CHEBI:50860)
Synonym  Source
AlPCS4SUBMITTER
Citations