Vitas-M small molecule compound
methyl (4Z)-1-[2-(cyclohex-1-en-1-yl)ethyl]-4-(2-hydroxybenzylidene)-2-methyl-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
Catalog ID
STK161470
SMILES COC(=O)C1=C(C)N(C(=O)/C/1=C\c1ccccc1O)CCC1=CCCCC1
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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 C22H25NO4 MW 367.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H25NO4/c1-15-20(22(26)27-2)18(14-17-10-6-7-11-19(17)24)21(25)23(15)13-12-16-8-4-3-5-9-16/h6-8,10-11,14,24H,3-5,9,12-13H2,1-2H3/b18-14-InChIKey
BVAHNKQYHDXYRO-JXAWBTAJSA-NSynonyms
CC1=C(C(=CC2=CC=CC=C2O)C(=O)N1CCC3=CCCCC3)C(=O)OCCOC(=O)C1=C(C)N(C(=O)C1=Cc1ccccc1O)CCC1=CCCCC1
METHYL(4Z)1(2(CYCLOHEX1EN1YL)ETHYL)4(2HYDROXYBENZYLIDENE)2METHYL5OXO45DIHYDRO1HPYRROLE3CARBOXYLATE
METHYL(4Z)1(2(CYCLOHEXEN1YL)ETHYL)4((2HYDROXYPHENYL)METHYLIDENE)2METHYL5OXOPYRROLE3CARBOXYLATE
Registry IDs
MFCD03259856ZINC000001101751
ZINC01101751
ZINC1101751
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