Vitas-M small molecule compound
3-[(3a'S,6a'R)-5'-benzyl-5-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]propanoic acid
Catalog ID
STL530756
SMILES OC(=O)CCC1NC2([C@H]3[C@@H]1C(=O)N(C3=O)Cc1ccccc1)C(=O)Nc1c2cc(C)cc1
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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 C24H23N3O5 MW 433.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H23N3O5/c1-13-7-8-16-15(11-13)24(23(32)25-16)20-19(17(26-24)9-10-18(28)29)21(30)27(22(20)31)12-14-5-3-2-4-6-14/h2-8,11,17,19-20,26H,9-10,12H2,1H3,(H,25,32)(H,28,29)/t17?,19-,20+,24?/m1/s1InChIKey
YJTFAPLZYSXKBF-FYGMXOSSSA-NSynonyms
956966-62-416402301
3((3~(a)~(R)6~(a)~(S))5benzyl5methyl246trioxospiro(123~(a)6~(a)tetrahydropyrrolo(34c)pyrrole331~(H)indole)1yl)propanoicacid
3((3aS6aR)5benzyl5methyl246trioxo1233a4566aoctahydro2Hspiro(indole31pyrrolo(34c)pyrrol)3yl)propanoicacid
3((3aS6aR)5benzyl5methyl246trioxo33a4566ahexahydro2Hspiro(indoline31pyrrolo(34c)pyrrol)3yl)propanoicacid
956966624
InChI=1SC24H23N3O5c113781615(1113)24(23(32)2516)2019(17(2624)91018(28)29)21(30)27(22(20)31)12145324614h281117192026H91012H21H3(H2532)(H2829)t17?1920+24?m1s1
MFCD06493344
OC(=O)CCC1NC2((C@H)3(C@@H)1C(=O)N(C3=O)Cc1ccccc1)C(=O)Nc1c2cc(C)cc1
ZINC000002129172
ZINC000002129178
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.