Vitas-M small molecule compound
2-[1-(2,2-dimethoxyethyl)-2,5-diphenyl-1H-pyrrol-3-yl]-3-hydroxy-5,5-dimethylcyclohex-2-en-1-one
Catalog ID
STK874186
SMILES COC(Cn1c(c2ccccc2)c(cc1c1ccccc1)C1=C(O)CC(CC1=O)(C)C)OC
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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 C28H31NO4 MW 445.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H31NO4/c1-28(2)16-23(30)26(24(31)17-28)21-15-22(19-11-7-5-8-12-19)29(18-25(32-3)33-4)27(21)20-13-9-6-10-14-20/h5-15,25,30H,16-18H2,1-4H3InChIKey
QBVQMLPXEWDNAL-UHFFFAOYSA-NSynonyms
799800-02-52(1(22dimethoxyethyl)25diphenyl1Hpyrrol3yl)3hydroxy55dimethylcyclohex2en1one
2(1(22dimethoxyethyl)25diphenyl1Hpyrrol3yl)3hydroxy55dimethylcyclohex2enone
2(1(22DIMETHOXYETHYL)25DIPHENYLPYRROL3YL)3HYDROXY55DIMETHYLCYCLOHEX2EN1ONE
799800025
CC1(CC(=C(C(=O)C1)C2=C(N(C(=C2)C3=CC=CC=C3)CC(OC)OC)C4=CC=CC=C4)O)C
InChI=1SC28H31NO4c128(2)1623(30)26(24(31)1728)211522(19117581219)29(1825(323)334)27(21)201396101420h5152530H1618H214H3
MFCD03678127
ZINC000004391211
ZINC04391211
ZINC4391211
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