Vitas-M small molecule compound
{dimethyl 3,3'-[7,12-bis(1-methoxyethyl)-3,8,13,17-tetramethylporphyrin-2,18-diyl-kappa~2~N~21~,N~23~]dipropanoatato(2-)}cobalt
Catalog ID
STL525870
SMILES COC(=O)CCc1c(C)c2=CC3=NC(=Cc4n5[Co]n2c1=CC1=NC(=Cc5c(c4C(OC)C)C)C(=C1CCC(=O)OC)C)C(=C3C(OC)C)C
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C38H44CoN4O6 MW 711.72 g/mol Purity >90% as per NMR
InChI
InChI=1S/C38H44N4O6.Co/c1-19-25(11-13-35(43)47-9)31-18-32-26(12-14-36(44)48-10)20(2)28(40-32)16-33-38(24(6)46-8)22(4)30(42-33)17-34-37(23(5)45-7)21(3)29(41-34)15-27(19)39-31;/h15-18,23-24H,11-14H2,1-10H3;/q-2;+2/b27-15-,28-16-,29-15-,30-17-,31-18-,32-18-InChIKey
CLXKIPBVLVWKGW-XVSNTGNMSA-NSynonyms
71068-60-5(dimethyl33(712bis(1methoxyethyl)381317tetramethylporphyrin218diylkappa~2~N~21~N~23~)dipropanoatato(2))cobalt
71068605
COC(=O)CCc1c(C)c2=CC3=NC(=Cc4n5(Co)n2c1=CC1=NC(=Cc5c(c4C(OC)C)C)C(=C1CCC(=O)OC)C)C(=C3C(OC)C)C
InChI=1SC38H44N4O6Coc11925(111335(43)479)31183226(121436(44)4810)20(2)28(4032)163338(24(6)468)22(4)30(4233)173437(23(5)457)21(3)29(4134)1527(19)3931h15182324H1114H2110H3q2+2b27152816291530173118321833163417
MFCD00302471
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