Vitas-M small molecule compound
(4E)-1-benzyl-4-[hydroxy(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methylidene]-5-[3-(prop-2-en-1-yloxy)phenyl]pyrrolidine-2,3-dione
Catalog ID
STL045926
SMILES C=CCOc1cccc(c1)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 C30H27NO5 MW 481.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H27NO5/c1-3-14-35-24-11-7-10-21(17-24)27-26(28(32)22-12-13-25-23(16-22)15-19(2)36-25)29(33)30(34)31(27)18-20-8-5-4-6-9-20/h3-13,16-17,19,27,32H,1,14-15,18H2,2H3/b28-26+InChIKey
DMNHJTGVEJNYRR-BYCLXTJYSA-NSynonyms
(4E)1benzyl4(hydroxy(2methyl23dihydro1benzofuran5yl)methylidene)5(3(prop2en1yloxy)phenyl)pyrrolidine23dione
(4E)1BENZYL4(HYDROXY(2METHYL23DIHYDRO1BENZOFURAN5YL)METHYLIDENE)5(3PROP2ENOXYPHENYL)PYRROLIDINE23DIONE
C=CCOc1cccc(c1)C1C(=C(c2ccc3c(c2)CC(O3)C)O)C(=O)C(=O)N1Cc1ccccc1
CC1CC2=C(O1)C=CC(=C2)C(=C3C(N(C(=O)C3=O)CC4=CC=CC=C4)C5=CC(=CC=C5)OCC=C)O
InChI=1SC30H27NO5c131435241171021(1724)2726(28(32)2212132523(1622)1519(2)3625)29(33)30(34)31(27)18208546920h3131617192732H1141518H22H3b2826+
MFCD04072565
ZINC000101313624
ZINC000101313636
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