Vitas-M small molecule compound
2-{(3a'S,6a'R)-5'-[2-(3,4-dimethoxyphenyl)ethyl]-7-methyl-2,4',6'-trioxo-1,2,3',3a',4',5',6',6a'-octahydro-2'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrol]-3'-yl}acetamide
Catalog ID
STL530244
SMILES COc1cc(CCN2C(=O)[C@H]3[C@@H](C2=O)C2(NC3CC(=O)N)C(=O)Nc3c2cccc3C)ccc1OC
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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 C26H28N4O6 MW 492.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H28N4O6/c1-13-5-4-6-15-22(13)28-25(34)26(15)21-20(16(29-26)12-19(27)31)23(32)30(24(21)33)10-9-14-7-8-17(35-2)18(11-14)36-3/h4-8,11,16,20-21,29H,9-10,12H2,1-3H3,(H2,27,31)(H,28,34)/t16?,20-,21+,26?/m1/s1InChIKey
KJDHFVIVMXGJFJ-USNAGLCPSA-NSynonyms
956948-54-216404847
2((3~(a)~(R)6~(a)~(S))5(2(34dimethoxyphenyl)ethyl)7methyl246trioxospiro(123~(a)6~(a)tetrahydropyrrolo(34c)pyrrole331~(H)indole)1yl)acetamide
2((3aS6aR)5(2(34dimethoxyphenyl)ethyl)7methyl246trioxo1233a4566aoctahydro2Hspiro(indole31pyrrolo(34c)pyrrol)3yl)acetamide
2((3aS6aR)5(34dimethoxyphenethyl)7methyl246trioxo33a4566ahexahydro2Hspiro(indoline31pyrrolo(34c)pyrrol)3yl)acetamide
956948542
COc1cc(CCN2C(=O)(C@H)3(C@@H)(C2=O)C2(NC3CC(=O)N)C(=O)Nc3c2cccc3C)ccc1OC
InChI=1SC26H28N4O6c1135461522(13)2825(34)26(15)2120(16(2926)1219(27)31)23(32)30(24(21)33)109147817(352)18(1114)363h481116202129H91012H213H3(H22731)(H2834)t16?2021+26?m1s1
MFCD06768249
ZINC000015969213
ZINC000020755868
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.