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Protoporphyrinato zinc

Catalog Number
ACM15442645
CAS Number
15442-64-5
Product Name
Protoporphyrinato zinc
Structure
Category
Other Materials
Synonyms
PROTOPORPHYRINATO ZINC;dihydrogen [3,8,13,17-tetramethyl-7,12-divinyl-21H,23H-porphine-2,18-dipropionato(4-)-N21,N22,N23,N24]zincate(4-);Zinc protoporphyrin trihydrate;Zinc protoporphyrin trihydrate, 95+%
IUPAC Name
zinc;3-[18-(2-carboxyethyl)-8,13-bis(ethenyl)-3,7,12,17-tetramethylporphyrin-21,23-diid-2-yl]propanoic acid
Molecular Weight
626g/mol
Molecular Formula
C34H32N4O4Zn
Canonical SMILES
CC1=C(C2=CC3=NC(=CC4=C(C(=C([N-]4)C=C5C(=C(C(=N5)C=C1[N-]2)C)C=C)C)C=C)C(=C3CCC(=O)O)C)CCC(=O)O.[Zn+2]
InChI
InChI=1S/C34H34N4O4.Zn/c1-7-21-17(3)25-13-26-19(5)23(9-11-33(39)40)31(37-26)16-32-24(10-12-34(41)42)20(6)28(38-32)15-30-22(8-2)18(4)27(36-30)14-29(21)35-25;/h7-8,13-16H,1-2,9-12H2,3-6H3,(H4,35,36,37,38,39,40,41,42);/q;+2/p-2
InChI Key
FUTVBRXUIKZACV-UHFFFAOYSA-L
Complexity
1580
Covalently-Bonded Unit Count
2
EC Number
239-455-7
Exact Mass
624.171497g/mol
Formal Charge
0
Heavy Atom Count
43
MeSH Entry Terms
zinc protoporphyrin;zinc protoporphyrin IX;zinc-protoporphyrin-9;ZnPP-IX;ZnPP9
Monoisotopic Mass
624.171497g/mol
Rotatable Bond Count
8
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