Vitas-M small molecule compound
3-[4,6-dioxo-3-phenyl-5-(4-propoxyphenyl)hexahydro-2H-pyrrolo[3,4-d][1,2]oxazol-2-yl]-3-phenylpropanoic acid
Catalog ID
STL342214
SMILES CCCOc1ccc(cc1)N1C(=O)C2C(C1=O)ON(C2c1ccccc1)C(c1ccccc1)CC(=O)O
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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 C29H28N2O6 MW 500.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H28N2O6/c1-2-17-36-22-15-13-21(14-16-22)30-28(34)25-26(20-11-7-4-8-12-20)31(37-27(25)29(30)35)23(18-24(32)33)19-9-5-3-6-10-19/h3-16,23,25-27H,2,17-18H2,1H3,(H,32,33)InChIKey
ATDHMUDZGKYGBE-UHFFFAOYSA-NSynonyms
1022694-24-11022694241
3(46DIOXO3PHENYL5(4PROPOXYPHENYL)3A6ADIHYDRO3HPYRROLO(34D)(12)OXAZOL2YL)3PHENYLPROPANOICACID
3(46dioxo3phenyl5(4propoxyphenyl)hexahydro2Hpyrrolo(34d)(12)oxazol2yl)3phenylpropanoicacid
3(46DIOXO3PHENYL5(4PROPOXYPHENYL)HEXAHYDRO2HPYRROLO(34D)ISOXAZOL2YL)3PHENYLPROPANOICACID
CCCOC1=CC=C(C=C1)N2C(=O)C3C(N(OC3C2=O)C(CC(=O)O)C4=CC=CC=C4)C5=CC=CC=C5
InChI=1SC29H28N2O6c12173622151321(141622)3028(34)2526(20117481220)31(3727(25)29(30)35)23(1824(32)33)1995361019h316232527H21718H21H3(H3233)
MFCD04033536
ZINC000102736805
ZINC000245309095
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