Vitas-M small molecule compound
6'-hydroxy-7,9,9-trimethyl-3-nitro-3'-phenyl-6a,7,8,9,10,11-hexahydro-2'H,5H-spiro[7,11-methanoazepino[1,2-a]quinoline-6,5'-pyrimidine]-2',4'(3'H)-dione
Catalog ID
STK608763
SMILES O=C1N=C(O)C2(C(=O)N1c1ccccc1)Cc1cc(ccc1N1C2C2(C)CC1CC(C2)(C)C)[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 C27H28N4O5 MW 488.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H28N4O5/c1-25(2)13-19-14-26(3,15-25)21-27(12-16-11-18(31(35)36)9-10-20(16)29(19)21)22(32)28-24(34)30(23(27)33)17-7-5-4-6-8-17/h4-11,19,21H,12-15H2,1-3H3,(H,28,32,34)InChIKey
AODBAAYJCSXDOF-UHFFFAOYSA-NSynonyms
1177942-96-91177942969
6hydroxy799trimethyl3nitro3phenyl6a7891011hexahydro2H5Hspiro(711methanoazepino(12a)quinoline65pyrimidine)24(3H)dione
MFCD08736394
O=C1N=C(O)C2(C(=O)N1c1ccccc1)Cc1cc(ccc1N1C2C2(C)CC1CC(C2)(C)C)(N+)(=O)(O)
ZINC000009186226
ZINC000227118421
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.