Vitas-M small molecule compound

(1,3,5,7-tetraoxo-5,7-dihydropyrrolo[3,4-f]isoindole-2,6(1H,3H)-diyl)bis(benzene-4,1-diyl-2-oxoethane-2,1-diyl) dibenzoate

Catalog ID
STK270208
SMILES O=C(c1ccc(cc1)n1c(=O)c2c(c1=O)cc1c(c2)c(=O)n(c1=O)c1ccc(cc1)C(=O)COC(=O)c1ccccc1)COC(=O)c1ccccc1

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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 C40H24N2O10 MW 692.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C40H24N2O10/c43-33(21-51-39(49)25-7-3-1-4-8-25)23-11-15-27(16-12-23)41-35(45)29-19-31-32(20-30(29)36(41)46)38(48)42(37(31)47)28-17-13-24(14-18-28)34(44)22-52-40(50)26-9-5-2-6-10-26/h1-20H,21-22H2
InChIKey
XLOYZFAOHNWHOP-UHFFFAOYSA-N
Synonyms

(1357tetraoxo57dihydropyrrolo(34f)isoindole26(1H3H)diyl)bis(benzene41diyl2oxoethane21diyl)dibenzoate
(2(4(2(4(2benzoyloxyacetyl)phenyl)1357tetraoxopyrrolo(34f)isoindol6yl)phenyl)2oxoethyl)benzoate
C1=CC=C(C=C1)C(=O)OCC(=O)C2=CC=C(C=C2)N3C(=O)C4=CC5=C(C=C4C3=O)C(=O)N(C5=O)C6=CC=C(C=C6)C(=O)COC(=O)C7=CC=CC=C7
InChI=1SC40H24N2O10c4333(215139(49)257314825)23111527(161223)4135(45)29193132(2030(29)36(41)46)38(48)42(37(31)47)28171324(141828)34(44)225240(50)2695261026h120H2122H2
MFCD03901076
ZINC000097949258
ZINC97949258

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Available files

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