Vitas-M small molecule compound
(6aS,6bR,9aS,10R)-N-(2,5-dimethoxyphenyl)-8-(4-nitrophenyl)-7,9-dioxo-6b,7,8,9,9a,10-hexahydro-6aH-pyrrolo[3',4':3,4]pyrrolo[1,2-a]quinoline-10-carboxamide
Catalog ID
STK555269
SMILES COc1ccc(c(c1)NC(=O)[C@@H]1N2[C@H]([C@H]3[C@@H]1C(=O)N(C3=O)c1ccc(cc1)[N+](=O)[O-])C=Cc1c2cccc1)OC
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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 C29H24N4O7 MW 540.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H24N4O7/c1-39-19-12-14-23(40-2)20(15-19)30-27(34)26-25-24(22-13-7-16-5-3-4-6-21(16)32(22)26)28(35)31(29(25)36)17-8-10-18(11-9-17)33(37)38/h3-15,22,24-26H,1-2H3,(H,30,34)/t22-,24-,25-,26+/m0/s1InChIKey
RMFPQTYHSOMBIJ-ZCLKUGBOSA-NSynonyms
1014083-15-8(6aS6bR9aS10R)N(25dimethoxyphenyl)8(4nitrophenyl)79dioxo6b7899a10hexahydro6aHpyrrolo(3434)pyrrolo(12a)quinoline10carboxamide
1014083158
COC1=CC(=C(C=C1)OC)NC(=O)C2C3C(C4N2C5=CC=CC=C5C=C4)C(=O)N(C3=O)C6=CC=C(C=C6)(N+)(=O)(O)
COc1ccc(c(c1)NC(=O)(C@@H)1N2(C@H)((C@H)3(C@@H)1C(=O)N(C3=O)c1ccc(cc1)(N+)(=O)(O))C=Cc1c2cccc1)OC
InChI=1SC29H24N4O7c13919121423(402)20(1519)3027(34)262524(2213716534621(16)32(22)26)28(35)31(29(25)36)1781018(11917)33(37)38h315222426H12H3(H3034)t22242526+m0s1
MFCD18242854
ZINC000100884318
ZINC100884318
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.