Vitas-M small molecule compound
3'-[2-(3,4-dimethoxyphenyl)ethyl]-3-ethyl-6'-hydroxy-8-nitro-2,3,4,4a-tetrahydro-1H,2'H,6H-spiro[pyrazino[1,2-a]quinoline-5,5'-pyrimidine]-2',4'(3'H)-dione
Catalog ID
STK590987
SMILES CCN1CCN2C(C1)C1(Cc3c2ccc(c3)[N+](=O)[O-])C(=NC(=O)N(C1=O)CCc1ccc(c(c1)OC)OC)O
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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 C27H31N5O7 MW 537.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H31N5O7/c1-4-29-11-12-30-20-7-6-19(32(36)37)14-18(20)15-27(23(30)16-29)24(33)28-26(35)31(25(27)34)10-9-17-5-8-21(38-2)22(13-17)39-3/h5-8,13-14,23H,4,9-12,15-16H2,1-3H3,(H,28,33,35)InChIKey
NJTAKDZWBCGCFL-UHFFFAOYSA-NSynonyms
879469-49-51(2(34dimethoxyphenyl)ethyl)3ethyl8nitrospiro(13diazinane55244a6tetrahydro1Hpyrazino(12a)quinoline)246trione
3(2(34dimethoxyphenyl)ethyl)3ethyl6hydroxy8nitro2344atetrahydro1H2H6Hspiro(pyrazino(12a)quinoline55pyrimidine)24(3H)dione
879469495
CCN1CCN2C(C1)C1(Cc3c2ccc(c3)(N+)(=O)(O))C(=NC(=O)N(C1=O)CCc1ccc(c(c1)OC)OC)O
CCN1CCN2C(C1)C3(CC4=C2C=CC(=C4)(N+)(=O)(O))C(=O)NC(=O)N(C3=O)CCC5=CC(=C(C=C5)OC)OC
InChI=1SC27H31N5O7c1429111230207619(32(36)37)1418(20)1527(23(30)1629)24(33)2826(35)31(25(27)34)109175821(382)22(1317)393h58131423H49121516H213H3(H283335)
MFCD07211853
ZINC000097956941
ZINC000245326957
Check stock
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Check stock on Vitas-MAvailable files
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