Vitas-M small molecule compound
(3a'S,6a'R)-5'-cycloheptyl-7-ethyl-3'-(1-hydroxyethyl)-3a',6a'-dihydro-2'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrole]-2,4',6'(1H,3'H,5'H)-trione
Catalog ID
STK585352
SMILES CCc1cccc2c1NC(=O)C12NC([C@@H]2[C@H]1C(=O)N(C2=O)C1CCCCCC1)C(O)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 C24H31N3O4 MW 425.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H31N3O4/c1-3-14-9-8-12-16-20(14)25-23(31)24(16)18-17(19(26-24)13(2)28)21(29)27(22(18)30)15-10-6-4-5-7-11-15/h8-9,12-13,15,17-19,26,28H,3-7,10-11H2,1-2H3,(H,25,31)/t13?,17-,18-,19?,24?/m0/s1InChIKey
FIWJEROXCFEZOZ-QPUWOWNVSA-NSynonyms
1212480-97-1(3aR6aS)5cycloheptyl7ethyl1(1hydroxyethyl)spiro(123a6atetrahydropyrrolo(34c)pyrrole331Hindole)246trione
(3aS6aR)5cycloheptyl7ethyl3(1hydroxyethyl)33adihydro2Hspiro(indoline31pyrrolo(34c)pyrrole)246(5H6aH)trione
(3aS6aR)5cycloheptyl7ethyl3(1hydroxyethyl)3a6adihydro2Hspiro(indole31pyrrolo(34c)pyrrole)246(1H3H5H)trione
1212480971
CCC1=CC=CC2=C1NC(=O)C23C4C(C(N3)C(C)O)C(=O)N(C4=O)C5CCCCCC5
CCc1cccc2c1NC(=O)C12NC((C@@H)2(C@H)1C(=O)N(C2=O)C1CCCCCC1)C(O)C
InChI=1SC24H31N3O4c131498121620(14)2523(31)24(16)1817(19(2624)13(2)28)21(29)27(22(18)30)151064571115h8912131517192628H371011H212H3(H2531)t13?171819?24?m0s1
MFCD06775436
ZINC000016020715
ZINC000105348852
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.