Vitas-M small molecule compound
didecyl 4,4'-(1,3,5,7-tetraoxo-5,7-dihydropyrrolo[3,4-f]isoindole-2,6(1H,3H)-diyl)dibenzoate
Catalog ID
STK270209
SMILES CCCCCCCCCCOC(=O)c1ccc(cc1)n1c(=O)c2c(c1=O)cc1c(c2)c(=O)n(c1=O)c1ccc(cc1)C(=O)OCCCCCCCCCC
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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 C44H52N2O8 MW 736.91 g/mol Purity >90% as per NMR
InChI
InChI=1S/C44H52N2O8/c1-3-5-7-9-11-13-15-17-27-53-43(51)31-19-23-33(24-20-31)45-39(47)35-29-37-38(30-36(35)40(45)48)42(50)46(41(37)49)34-25-21-32(22-26-34)44(52)54-28-18-16-14-12-10-8-6-4-2/h19-26,29-30H,3-18,27-28H2,1-2H3InChIKey
XQMFCOMAZVZIHI-UHFFFAOYSA-NSynonyms
CCCCCCCCCCOC(=O)C1=CC=C(C=C1)N2C(=O)C3=CC4=C(C=C3C2=O)C(=O)N(C4=O)C5=CC=C(C=C5)C(=O)OCCCCCCCCCC
decyl4(2(4decoxycarbonylphenyl)1357tetraoxopyrrolo(34f)isoindol6yl)benzoate
didecyl44(1357tetraoxo57dihydropyrrolo(34f)isoindole26(1H3H)diyl)dibenzoate
InChI=1SC44H52N2O8c1357911131517275343(51)31192333(242031)4539(47)35293738(3036(35)40(45)48)42(50)46(41(37)49)34252132(222634)44(52)542818161412108642h19262930H3182728H212H3
MFCD00591980
ZINC000097996155
ZINC97996155
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