Vitas-M small molecule compound
3-(1,3-benzodioxol-5-ylmethyl)-1'-tert-butyl-2'-hydroxy-8-nitro-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
STK593905
SMILES OC1=NC(=O)C2(C(=O)N1C(C)(C)C)Cc1cc(ccc1N1C2CN(CC1)Cc1ccc2c(c1)OCO2)[N+](=O)[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 C27H29N5O7 MW 535.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H29N5O7/c1-26(2,3)31-24(34)27(23(33)28-25(31)35)12-17-11-18(32(36)37)5-6-19(17)30-9-8-29(14-22(27)30)13-16-4-7-20-21(10-16)39-15-38-20/h4-7,10-11,22H,8-9,12-15H2,1-3H3,(H,28,33,35)InChIKey
ONHOYVHVMSXBKI-UHFFFAOYSA-NSynonyms
879478-40-73(13benzodioxol5ylmethyl)1tertbutyl2hydroxy8nitro2344atetrahydro1H4H6Hspiro(pyrazino(12a)quinoline55pyrimidine)46(1H)dione
879478407
MFCD07212784
OC1=NC(=O)C2(C(=O)N1C(C)(C)C)Cc1cc(ccc1N1C2CN(CC1)Cc1ccc2c(c1)OCO2)(N+)(=O)(O)
ZINC000097956593
ZINC000230036061
Check stock
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Check stock on Vitas-MAvailable files
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