Vitas-M small molecule compound

2,6-bis(4-butoxyphenyl)-4-phenylhexahydro-4,8-ethenopyrrolo[3,4-f]isoindole-1,3,5,7(2H,6H)-tetrone

Catalog ID
STK720138
SMILES CCCCOc1ccc(cc1)N1C(=O)C2C(C1=O)C1(C=CC2C2C1C(=O)N(C2=O)c1ccc(cc1)OCCCC)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 C38H38N2O6 MW 618.73 g/mol Purity >90% as per NMR
InChI
InChI=1S/C38H38N2O6/c1-3-5-22-45-27-16-12-25(13-17-27)39-34(41)30-29-20-21-38(32(30)36(39)43,24-10-8-7-9-11-24)33-31(29)35(42)40(37(33)44)26-14-18-28(19-15-26)46-23-6-4-2/h7-21,29-33H,3-6,22-23H2,1-2H3
InChIKey
ZPQZWYOEDCAFHZ-UHFFFAOYSA-N
Synonyms

26bis(4butoxyphenyl)4phenyl44a88atetrahydro48ethenopyrrolo(34f)isoindole1357(2H3aH6H7aH)tetraone
26bis(4butoxyphenyl)4phenylhexahydro48ethenopyrrolo(34f)isoindole1357(2H6H)tetrone
CCCCOC1=CC=C(C=C1)N2C(=O)C3C4C=CC(C3C2=O)(C5C4C(=O)N(C5=O)C6=CC=C(C=C6)OCCCC)C7=CC=CC=C7
InChI=1SC38H38N2O6c135224527161225(131727)3934(41)3029202138(32(30)36(39)4324108791124)3331(29)35(42)40(37(33)44)26141828(191526)4623642h7212933H362223H212H3
MFCD01070775
ZINC000245329489
ZINC000245329492

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Available files

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