Vitas-M small molecule compound

(4E)-1-benzyl-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]-5-(4-hydroxy-3-methoxyphenyl)pyrrolidine-2,3-dione

Catalog ID
STK568706
SMILES COc1cc(ccc1O)C1/C(=C(/c2ccc3c(c2)OCCO3)\O)/C(=O)C(=O)N1Cc1ccccc1

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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 C27H23NO7 MW 473.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H23NO7/c1-33-21-13-17(7-9-19(21)29)24-23(25(30)18-8-10-20-22(14-18)35-12-11-34-20)26(31)27(32)28(24)15-16-5-3-2-4-6-16/h2-10,13-14,24,29-30H,11-12,15H2,1H3/b25-23+
InChIKey
IYJHLBNTLJCQCQ-WJTDDFOZSA-N
Synonyms
618856-32-9
(4E)1benzyl4(23dihydro14benzodioxin6yl(hydroxy)methylidene)5(4hydroxy3methoxyphenyl)pyrrolidine23dione
618856329
COC1=C(C=CC(=C1)C2C(=C(C3=CC4=C(C=C3)OCCO4)O)C(=O)C(=O)N2CC5=CC=CC=C5)O
COc1cc(ccc1O)C1C(=C(c2ccc3c(c2)OCCO3)O)C(=O)C(=O)N1Cc1ccccc1
InChI=1SC27H23NO7c133211317(7919(21)29)2423(25(30)188102022(1418)3512113420)26(31)27(32)28(24)15165324616h2101314242930H111215H21H3b2523+
MFCD05726923
ZINC000102553821
ZINC000102553832

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Available files

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