Vitas-M small molecule compound
(4E)-1-benzyl-4-[hydroxy(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methylidene]-5-[3-methoxy-4-(3-methylbutoxy)phenyl]pyrrolidine-2,3-dione
Catalog ID
STK565572
SMILES COc1cc(ccc1OCCC(C)C)C1/C(=C(/c2ccc3c(c2)CC(O3)C)\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 C33H35NO6 MW 541.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H35NO6/c1-20(2)14-15-39-27-13-10-23(18-28(27)38-4)30-29(31(35)24-11-12-26-25(17-24)16-21(3)40-26)32(36)33(37)34(30)19-22-8-6-5-7-9-22/h5-13,17-18,20-21,30,35H,14-16,19H2,1-4H3/b31-29+InChIKey
RUOPKXJHGLHQRE-OWWNRXNESA-NSynonyms
843630-17-1(4E)1benzyl4(hydroxy(2methyl23dihydro1benzofuran5yl)methylidene)5(3methoxy4(3methylbutoxy)phenyl)pyrrolidine23dione
843630171
CC1CC2=C(O1)C=CC(=C2)C(=C3C(N(C(=O)C3=O)CC4=CC=CC=C4)C5=CC(=C(C=C5)OCCC(C)C)OC)O
COc1cc(ccc1OCCC(C)C)C1C(=C(c2ccc3c(c2)CC(O3)C)O)C(=O)C(=O)N1Cc1ccccc1
InChI=1SC33H35NO6c120(2)14153927131023(1828(27)384)3029(31(35)2411122625(1724)1621(3)4026)32(36)33(37)34(30)19228657922h513171820213035H141619H214H3b3129+
MFCD04076883
ZINC000102535928
ZINC000102649058
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