Vitas-M small molecule compound
(4E)-1-benzyl-5-(4-butoxyphenyl)-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]pyrrolidine-2,3-dione
Catalog ID
STL042199
SMILES CCCCOc1ccc(cc1)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 C30H29NO6 MW 499.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H29NO6/c1-2-3-15-35-23-12-9-21(10-13-23)27-26(28(32)22-11-14-24-25(18-22)37-17-16-36-24)29(33)30(34)31(27)19-20-7-5-4-6-8-20/h4-14,18,27,32H,2-3,15-17,19H2,1H3/b28-26+InChIKey
LCKLXEPMIBRCQY-BYCLXTJYSA-NSynonyms
(4E)1benzyl5(4butoxyphenyl)4(23dihydro14benzodioxin6yl(hydroxy)methylidene)pyrrolidine23dione
CCCCOC1=CC=C(C=C1)C2C(=C(C3=CC4=C(C=C3)OCCO4)O)C(=O)C(=O)N2CC5=CC=CC=C5
CCCCOc1ccc(cc1)C1C(=C(c2ccc3c(c2)OCCO3)O)C(=O)C(=O)N1Cc1ccccc1
InChI=1SC30H29NO6c12315352312921(101323)2726(28(32)2211142425(1822)3717163624)29(33)30(34)31(27)19207546820h414182732H23151719H21H3b2826+
MFCD05728746
ZINC000102869327
ZINC000102869330
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