Vitas-M small molecule compound
methyl (4Z)-4-[2-(benzyloxy)benzylidene]-2-methyl-5-oxo-1-(tetrahydrofuran-2-ylmethyl)-4,5-dihydro-1H-pyrrole-3-carboxylate
Catalog ID
STK165133
SMILES COC(=O)C1=C(C)N(C(=O)/C/1=C\c1ccccc1OCc1ccccc1)CC1CCCO1
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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 C26H27NO5 MW 433.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H27NO5/c1-18-24(26(29)30-2)22(25(28)27(18)16-21-12-8-14-31-21)15-20-11-6-7-13-23(20)32-17-19-9-4-3-5-10-19/h3-7,9-11,13,15,21H,8,12,14,16-17H2,1-2H3/b22-15-InChIKey
GHEWFEXLRFYMMF-JCMHNJIXSA-NSynonyms
CC1=C(C(=CC2=CC=CC=C2OCC3=CC=CC=C3)C(=O)N1CC4CCCO4)C(=O)OC
COC(=O)C1=C(C)N(C(=O)C1=Cc1ccccc1OCc1ccccc1)CC1CCCO1
InChI=1SC26H27NO5c11824(26(29)302)22(25(28)27(18)1621128143121)152011671323(20)32171994351019h37911131521H812141617H212H3b2215
METHYL(4Z)2METHYL5OXO1(OXOLAN2YLMETHYL)4((2PHENYLMETHOXYPHENYL)METHYLIDENE)PYRROLE3CARBOXYLATE
METHYL(4Z)4(2(BENZYLOXY)BENZYLIDENE)2METHYL5OXO1(TETRAHYDROFURAN2YLMETHYL)45DIHYDRO1HPYRROLE3CARBOXYLATE
MFCD03068172
ZINC000009846610
ZINC000009846611
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