Vitas-M small molecule compound
2'-hydroxy-8-nitro-3-[(2E)-3-phenylprop-2-en-1-yl]-1'-(propan-2-yl)-2,3,4,4a-tetrahydro-1H,4'H,6H-spiro[pyrazino[1,2-a]quinoline-5,5'-pyrimidine]-4',6'(1'H)-dione
Catalog ID
STK609833
SMILES CC(N1C(=NC(=O)C2(C1=O)Cc1cc(ccc1N1C2CN(C/C=C/c2ccccc2)CC1)[N+](=O)[O-])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 C27H29N5O5 MW 503.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H29N5O5/c1-18(2)31-25(34)27(24(33)28-26(31)35)16-20-15-21(32(36)37)10-11-22(20)30-14-13-29(17-23(27)30)12-6-9-19-7-4-3-5-8-19/h3-11,15,18,23H,12-14,16-17H2,1-2H3,(H,28,33,35)/b9-6+InChIKey
GZHCOHGDFOZHSR-RMKNXTFCSA-NSynonyms
929871-50-12hydroxy8nitro3((2E)3phenylprop2en1yl)1(propan2yl)2344atetrahydro1H4H6Hspiro(pyrazino(12a)quinoline55pyrimidine)46(1H)dione
8nitro3((E)3phenylprop2enyl)1propan2ylspiro(13diazinane55244a6tetrahydro1Hpyrazino(12a)quinoline)246trione
929871501
CC(C)N1C(=O)C2(CC3=C(C=CC(=C3)(N+)(=O)(O))N4C2CN(CC4)CC=CC5=CC=CC=C5)C(=O)NC1=O
CC(N1C(=NC(=O)C2(C1=O)Cc1cc(ccc1N1C2CN(CC=Cc2ccccc2)CC1)(N+)(=O)(O))O)C
InChI=1SC27H29N5O5c118(2)3125(34)27(24(33)2826(31)35)16201521(32(36)37)101122(20)30141329(1723(27)30)1269197435819h311151823H12141617H212H3(H283335)b96+
MFCD18158648
ZINC000057140625
ZINC000229937376
Check stock
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