Vitas-M small molecule compound

(4E)-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]-5-[3-ethoxy-4-(pentyloxy)phenyl]-1-(2-methoxyethyl)pyrrolidine-2,3-dione

Catalog ID
STL053431
SMILES CCCCCOc1ccc(cc1OCC)C1/C(=C(/c2ccc3c(c2)OCCO3)\O)/C(=O)C(=O)N1CCOC

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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 C29H35NO8 MW 525.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H35NO8/c1-4-6-7-13-36-21-10-8-19(17-23(21)35-5-2)26-25(28(32)29(33)30(26)12-14-34-3)27(31)20-9-11-22-24(18-20)38-16-15-37-22/h8-11,17-18,26,31H,4-7,12-16H2,1-3H3/b27-25+
InChIKey
AIQOJTSJBFBIBE-IMVLJIQESA-N
Synonyms
620558-74-9
(4E)4(23dihydro14benzodioxin6yl(hydroxy)methylidene)5(3ethoxy4(pentyloxy)phenyl)1(2methoxyethyl)pyrrolidine23dione
(4E)4(23DIHYDRO14BENZODIOXIN6YL(HYDROXY)METHYLIDENE)5(3ETHOXY4PENTOXYPHENYL)1(2METHOXYETHYL)PYRROLIDINE23DIONE
620558749
CCCCCOC1=C(C=C(C=C1)C2C(=C(C3=CC4=C(C=C3)OCCO4)O)C(=O)C(=O)N2CCOC)OCC
CCCCCOc1ccc(cc1OCC)C1C(=C(c2ccc3c(c2)OCCO3)O)C(=O)C(=O)N1CCOC
InChI=1SC29H35NO8c146713362110819(1723(21)3552)2625(28(32)29(33)30(26)1214343)27(31)209112224(1820)3816153722h81117182631H471216H213H3b2725+
MFCD05727054
ZINC000102891311
ZINC000102891313

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Available files

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