Vitas-M small molecule compound
(6aR,6bS,9aR,10S)-8-(2-methyl-5-nitrophenyl)-10-(phenylcarbonyl)-9a,10-dihydro-6aH-benzo[f]pyrrolo[3',4':3,4]pyrrolo[1,2-a]quinoline-7,9(6bH,8H)-dione
Catalog ID
STK535492
SMILES O=C([C@@H]1[C@@H]2C(=O)N(C(=O)[C@@H]2[C@@H]2N1c1ccc3c(c1C=C2)cccc3)c1cc(ccc1C)[N+](=O)[O-])c1ccccc1
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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 C32H23N3O5 MW 529.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H23N3O5/c1-18-11-13-21(35(39)40)17-26(18)34-31(37)27-25-16-14-23-22-10-6-5-7-19(22)12-15-24(23)33(25)29(28(27)32(34)38)30(36)20-8-3-2-4-9-20/h2-17,25,27-29H,1H3/t25-,27-,28-,29+/m1/s1InChIKey
CORKNRFVHAWXMO-PXTYPYQWSA-NSynonyms
(6aR6bS9aR10S)8(2methyl5nitrophenyl)10(phenylcarbonyl)9a10dihydro6aHbenzo(f)pyrrolo(3434)pyrrolo(12a)quinoline79(6bH8H)dione
(8aR8bS11aR12S)12benzoyl10(2methyl5nitrophenyl)11a12dihydro8aHbenzo(f)pyrrolo(3434)pyrrolo(12a)quinoline911(8bH10H)dione
CC1=C(C=C(C=C1)(N+)(=O)(O))N2C(=O)C3C4C=CC5=C(N4C(C3C2=O)C(=O)C6=CC=CC=C6)C=CC7=CC=CC=C75
InChI=1SC32H23N3O5c118111321(35(39)40)1726(18)3431(37)2725161423221065719(22)121524(23)33(25)29(28(27)32(34)38)30(36)208324920h217252729H1H3t25272829+m1s1
MFCD18241647
O=C((C@@H)1(C@@H)2C(=O)N(C(=O)(C@@H)2(C@@H)2N1c1ccc3c(c1C=C2)cccc3)c1cc(ccc1C)(N+)(=O)(O))c1ccccc1
ZINC000100781359
ZINC100781359
Check stock
See real-time availability and sample size for STK535492 on the Vitas-M platform.
Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.