Vitas-M small molecule compound

ethyl 4-[(3a'S,6a'R)-3'-(2-amino-2-oxoethyl)-6,7-dimethyl-2,4',6'-trioxo-1,2,2',3',3a',4',6',6a'-octahydro-5'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrol]-5'-yl]benzoate

Catalog ID
STL532834
SMILES CCOC(=O)c1ccc(cc1)N1C(=O)[C@H]2[C@@H](C1=O)C1(NC2CC(=O)N)C(=O)Nc2c1ccc(c2C)C

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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 C26H26N4O6 MW 490.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H26N4O6/c1-4-36-24(34)14-6-8-15(9-7-14)30-22(32)19-17(11-18(27)31)29-26(20(19)23(30)33)16-10-5-12(2)13(3)21(16)28-25(26)35/h5-10,17,19-20,29H,4,11H2,1-3H3,(H2,27,31)(H,28,35)/t17?,19-,20+,26?/m1/s1
InChIKey
XCDFFUTZDOEVTN-KKROQMRUSA-N
Synonyms
956824-40-1
16402817
956824401
CCOC(=O)c1ccc(cc1)N1C(=O)(C@H)2(C@@H)(C1=O)C1(NC2CC(=O)N)C(=O)Nc2c1ccc(c2C)C
ethyl4((3~(a)~(R)6~(a)~(S))1(2amino2oxoethyl)67dimethyl246trioxospiro(123~(a)6~(a)tetrahydropyrrolo(34c)pyrrole331~(H)indole)5yl)benzoate
ethyl4((3aS6aR)3(2amino2oxoethyl)67dimethyl246trioxo12233a466aoctahydro5Hspiro(indole31pyrrolo(34c)pyrrol)5yl)benzoate
ethyl4((3aS6aR)3(2amino2oxoethyl)67dimethyl246trioxo3a466atetrahydro2Hspiro(indoline31pyrrolo(34c)pyrrol)5(3H)yl)benzoate
InChI=1SC26H26N4O6c143624(34)146815(9714)3022(32)1917(1118(27)31)2926(20(19)23(30)33)1610512(2)13(3)21(16)2825(26)35h51017192029H411H213H3(H22731)(H2835)t17?1920+26?m1s1
MFCD06494452
ZINC000015957925
ZINC000035363854

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Available files

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