Vitas-M small molecule compound
(4E)-1-benzyl-5-(4-tert-butylphenyl)-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]pyrrolidine-2,3-dione
Catalog ID
STL055541
SMILES O/C(=C\1/C(=O)C(=O)N(C1c1ccc(cc1)C(C)(C)C)Cc1ccccc1)/c1ccc2c(c1)OCCO2
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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 C30H29NO5 MW 483.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H29NO5/c1-30(2,3)22-12-9-20(10-13-22)26-25(27(32)21-11-14-23-24(17-21)36-16-15-35-23)28(33)29(34)31(26)18-19-7-5-4-6-8-19/h4-14,17,26,32H,15-16,18H2,1-3H3/b27-25+InChIKey
QRTLTUCCKDGINS-IMVLJIQESA-NSynonyms
586993-98-8(4E)1benzyl5(4tertbutylphenyl)4(23dihydro14benzodioxin6yl(hydroxy)methylidene)pyrrolidine23dione
586993988
CC(C)(C)C1=CC=C(C=C1)C2C(=C(C3=CC4=C(C=C3)OCCO4)O)C(=O)C(=O)N2CC5=CC=CC=C5
InChI=1SC30H29NO5c130(23)2212920(101322)2625(27(32)2111142324(1721)3616153523)28(33)29(34)31(26)18197546819h414172632H151618H213H3b2725+
MFCD05728294
OC(=C1C(=O)C(=O)N(C1c1ccc(cc1)C(C)(C)C)Cc1ccccc1)c1ccc2c(c1)OCCO2
ZINC000102894773
ZINC000102894774
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