Vitas-M small molecule compound

ethyl 4-[5-(4-methylphenyl)-1',3',4,6-tetraoxo-1',3,3',3a,4,5,6,6a-octahydrospiro[furo[3,4-c]pyrrole-1,2'-inden]-3-yl]benzoate

Catalog ID
STK789296
SMILES CCOC(=O)c1ccc(cc1)C1OC2(C3C1C(=O)N(C3=O)c1ccc(cc1)C)C(=O)c1c(C2=O)cccc1

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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 C30H23NO7 MW 509.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H23NO7/c1-3-37-29(36)18-12-10-17(11-13-18)24-22-23(28(35)31(27(22)34)19-14-8-16(2)9-15-19)30(38-24)25(32)20-6-4-5-7-21(20)26(30)33/h4-15,22-24H,3H2,1-2H3
InChIKey
VEQRMNHBAWMHTL-UHFFFAOYSA-N
Synonyms
303037-09-4
303037094
5(4METHYLPHENYL)3(4(ETHOXYCARBONYL)PHENYL)46DIOXOHEXAHYDROSPIRO(1HFURO(34C)PYRROLE12(13)DIOXOINDANE)
CCOC(=O)C1=CC=C(C=C1)C2C3C(C(=O)N(C3=O)C4=CC=C(C=C4)C)C5(O2)C(=O)C6=CC=CC=C6C5=O
ethyl4(1346tetraoxo5(ptolyl)133a34566aoctahydrospiro(furo(34c)pyrrole12inden)3yl)benzoate
ethyl4(5(4methylphenyl)1346tetraoxo1333a4566aoctahydrospiro(furo(34c)pyrrole12inden)3yl)benzoate
ethyl4(5(4methylphenyl)1346tetraoxospiro(3a6adihydro1Hfuro(34c)pyrrole32indene)1yl)benzoate
InChI=1SC30H23NO7c133729(36)18121017(111318)242223(28(35)31(27(22)34)1914816(2)91519)30(3824)25(32)20645721(20)26(30)33h4152224H3H212H3
MFCD01036954
ZINC000013511270
ZINC000169617000

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.