Vitas-M small molecule compound
ethyl 4-(5-ethyl-1',2,3'-trioxo-1,1',2,3',3a',6',7',8',8a',8b'-decahydro-2'H-spiro[indole-3,4'-pyrrolo[3,4-a]pyrrolizin]-2'-yl)benzoate
Catalog ID
STL553574
SMILES CCOC(=O)c1ccc(cc1)N1C(=O)C2C(C1=O)C1(N3C2CCC3)C(=O)Nc2c1cc(CC)cc2
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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 C27H27N3O5 MW 473.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H27N3O5/c1-3-15-7-12-19-18(14-15)27(26(34)28-19)22-21(20-6-5-13-29(20)27)23(31)30(24(22)32)17-10-8-16(9-11-17)25(33)35-4-2/h7-12,14,20-22H,3-6,13H2,1-2H3,(H,28,34)InChIKey
UYTQJFCWQDZMCT-UHFFFAOYSA-NSynonyms
4834240
CCOC(=O)c1ccc(cc1)N1C(=O)(C@H)2(C@@H)(C1=O)(C@@)1(N3(C@H)2CCC3)C(=O)Nc2c1cc(CC)cc2
ethyl4((3S3aR8aS8bS)5ethyl123trioxo33a6788ahexahydro1Hspiro(indoline34pyrrolo(34a)pyrrolizine)2(8bH)yl)benzoate
ethyl4(5ethyl123trioxo11233a6788a8bdecahydro2Hspiro(indole34pyrrolo(34a)pyrrolizin)2yl)benzoate
ethyl4(5ethyl123trioxospiro(1~(H)indole343~(a)6788~(a)8~(b)hexahydropyrrolo(34a)pyrrolizine)2yl)benzoate
InChI=1SC27H27N3O5c13157121918(1415)27(26(34)2819)2221(20651329(20)27)23(31)30(24(22)32)1710816(91117)25(33)3542h712142022H3613H212H3(H2834)
MFCD09698255
ZINC000002128673
ZINC000504669290
Check stock
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Check stock on Vitas-MAvailable files
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