Vitas-M small molecule compound
3-[(3a'S,6a'R)-7-methyl-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
STL529706
SMILES OC(=O)CCC1NC2([C@H]3[C@@H]1C(=O)N(C3=O)CCc1ccccc1)C(=O)Nc1c2cccc1C
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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 C25H25N3O5 MW 447.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H25N3O5/c1-14-6-5-9-16-21(14)26-24(33)25(16)20-19(17(27-25)10-11-18(29)30)22(31)28(23(20)32)13-12-15-7-3-2-4-8-15/h2-9,17,19-20,27H,10-13H2,1H3,(H,26,33)(H,29,30)/t17?,19-,20+,25?/m1/s1InChIKey
HRLBJLBAUIJCAE-UIMQCXHPSA-NSynonyms
956940-52-616404579
3((3~(a)~(R)6~(a)~(S))7methyl246trioxo5(2phenylethyl)spiro(123~(a)6~(a)tetrahydropyrrolo(34c)pyrrole331~(H)indole)1yl)propanoicacid
3((3aS6aR)7methyl246trioxo5(2phenylethyl)1233a4566aoctahydro2Hspiro(indole31pyrrolo(34c)pyrrol)3yl)propanoicacid
3((3aS6aR)7methyl246trioxo5phenethyl33a4566ahexahydro2Hspiro(indoline31pyrrolo(34c)pyrrol)3yl)propanoicacid
956940526
InChI=1SC25H25N3O5c1146591621(14)2624(33)25(16)2019(17(2725)101118(29)30)22(31)28(23(20)32)1312157324815h2917192027H1013H21H3(H2633)(H2930)t17?1920+25?m1s1
MFCD06767508
OC(=O)CCC1NC2((C@H)3(C@@H)1C(=O)N(C3=O)CCc1ccccc1)C(=O)Nc1c2cccc1C
ZINC000008790764
ZINC000008790768
Check stock
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Check stock on Vitas-MAvailable files
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