Vitas-M small molecule compound

(4E)-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]-1-(furan-2-ylmethyl)-5-[3-(prop-2-en-1-yloxy)phenyl]pyrrolidine-2,3-dione

Catalog ID
STL053053
SMILES C=CCOc1cccc(c1)C1/C(=C(/c2ccc3c(c2)OCCO3)\O)/C(=O)C(=O)N1Cc1ccco1

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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/c1-2-10-32-19-6-3-5-17(14-19)24-23(26(30)27(31)28(24)16-20-7-4-11-33-20)25(29)18-8-9-21-22(15-18)35-13-12-34-21/h2-9,11,14-15,24,29H,1,10,12-13,16H2/b25-23+
InChIKey
IRWNTLUQWNTFLX-WJTDDFOZSA-N
Synonyms
577769-20-1
(4E)4(23dihydro14benzodioxin6yl(hydroxy)methylidene)1(furan2ylmethyl)5(3(prop2en1yloxy)phenyl)pyrrolidine23dione
(4E)4(23DIHYDRO14BENZODIOXIN6YL(HYDROXY)METHYLIDENE)1(FURAN2YLMETHYL)5(3PROP2ENOXYPHENYL)PYRROLIDINE23DIONE
5(3(ALLYLOXY)PHENYL)4(23DIHYDRO14BENZODIOXIN6YLCARBONYL)1(2FURYLMETHYL)3HYDROXY15DIHYDRO2HPYRROL2ONE
577769201
C=CCOC1=CC=CC(=C1)C2C(=C(C3=CC4=C(C=C3)OCCO4)O)C(=O)C(=O)N2CC5=CC=CO5
C=CCOc1cccc(c1)C1C(=C(c2ccc3c(c2)OCCO3)O)C(=O)C(=O)N1Cc1ccco1
InChI=1SC27H23NO7c1210321963517(1419)2423(26(30)27(31)28(24)162074113320)25(29)18892122(1518)3513123421h291114152429H110121316H2b2523+
MFCD05727320
ZINC000101313891
ZINC000101313895

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.