Vitas-M small molecule compound
3-[(3a'S,6a'R)-5'-cyclopentyl-6,7-dimethyl-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
STL532617
SMILES OC(=O)CCC1NC2([C@H]3[C@@H]1C(=O)N(C3=O)C1CCCC1)C(=O)Nc1c2ccc(c1C)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 C23H27N3O5 MW 425.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H27N3O5/c1-11-7-8-14-19(12(11)2)24-22(31)23(14)18-17(15(25-23)9-10-16(27)28)20(29)26(21(18)30)13-5-3-4-6-13/h7-8,13,15,17-18,25H,3-6,9-10H2,1-2H3,(H,24,31)(H,27,28)/t15?,17-,18+,23?/m1/s1InChIKey
PCTAVKIIFJGKCY-IBBBCHJRSA-NSynonyms
956966-47-516402230
3((3~(a)~(R)6~(a)~(S))5cyclopentyl67dimethyl246trioxospiro(123~(a)6~(a)tetrahydropyrrolo(34c)pyrrole331~(H)indole)1yl)propanoicacid
3((3aS6aR)5cyclopentyl67dimethyl246trioxo1233a4566aoctahydro2Hspiro(indole31pyrrolo(34c)pyrrol)3yl)propanoicacid
3((3aS6aR)5cyclopentyl67dimethyl246trioxo33a4566ahexahydro2Hspiro(indoline31pyrrolo(34c)pyrrol)3yl)propanoicacid
956966475
InChI=1SC23H27N3O5c111781419(12(11)2)2422(31)23(14)1817(15(2523)91016(27)28)20(29)26(21(18)30)13534613h781315171825H36910H212H3(H2431)(H2728)t15?1718+23?m1s1
MFCD06493197
OC(=O)CCC1NC2((C@H)3(C@@H)1C(=O)N(C3=O)C1CCCC1)C(=O)Nc1c2ccc(c1C)C
ZINC000002128886
ZINC000002128889
Check stock
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Check stock on Vitas-MAvailable files
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