Vitas-M small molecule compound
3-[(3a'S,6a'R)-5,7-dimethyl-2,4',6'-trioxo-5'-(2-phenylethyl)-1,2,3',3a',4',5',6',6a'-octahydro-2'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrol]-3'-yl]propanoic acid
Catalog ID
STL531927
SMILES OC(=O)CCC1NC2([C@H]3[C@@H]1C(=O)N(C3=O)CCc1ccccc1)C(=O)Nc1c2cc(C)cc1C
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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 C26H27N3O5 MW 461.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H27N3O5/c1-14-12-15(2)22-17(13-14)26(25(34)27-22)21-20(18(28-26)8-9-19(30)31)23(32)29(24(21)33)11-10-16-6-4-3-5-7-16/h3-7,12-13,18,20-21,28H,8-11H2,1-2H3,(H,27,34)(H,30,31)/t18?,20-,21+,26?/m1/s1InChIKey
WDOSHAZEVLFMIE-FOXWCKEESA-NSynonyms
956975-34-116404095
3((3~(a)~(R)6~(a)~(S))57dimethyl246trioxo5(2phenylethyl)spiro(123~(a)6~(a)tetrahydropyrrolo(34c)pyrrole331~(H)indole)1yl)propanoicacid
3((3aS6aR)57dimethyl246trioxo5(2phenylethyl)1233a4566aoctahydro2Hspiro(indole31pyrrolo(34c)pyrrol)3yl)propanoicacid
3((3aS6aR)57dimethyl246trioxo5phenethyl33a4566ahexahydro2Hspiro(indoline31pyrrolo(34c)pyrrol)3yl)propanoicacid
956975341
InChI=1SC26H27N3O5c1141215(2)2217(1314)26(25(34)2722)2120(18(2826)8919(30)31)23(32)29(24(21)33)1110166435716h37121318202128H811H212H3(H2734)(H3031)t18?2021+26?m1s1
MFCD06766115
OC(=O)CCC1NC2((C@H)3(C@@H)1C(=O)N(C3=O)CCc1ccccc1)C(=O)Nc1c2cc(C)cc1C
ZINC000008790325
ZINC000012882751
Check stock
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Check stock on Vitas-MAvailable files
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