Vitas-M small molecule compound
diphenylmethyl (6aR,6bS,9aR,10S)-8-(2-methyl-4-nitrophenyl)-7,9-dioxo-6b,7,8,9,9a,10-hexahydro-6aH-pyrrolo[3',4':3,4]pyrrolo[1,2-a]quinoline-10-carboxylate
Catalog ID
STK544263
SMILES O=C([C@H]1N2[C@@H]([C@@H]3[C@H]1C(=O)N(C3=O)c1ccc(cc1C)[N+](=O)[O-])C=Cc1c2cccc1)OC(c1ccccc1)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 C35H27N3O6 MW 585.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C35H27N3O6/c1-21-20-25(38(42)43)17-19-26(21)37-33(39)29-28-18-16-22-10-8-9-15-27(22)36(28)31(30(29)34(37)40)35(41)44-32(23-11-4-2-5-12-23)24-13-6-3-7-14-24/h2-20,28-32H,1H3/t28-,29-,30-,31+/m1/s1InChIKey
OUSQTBGMORHWRY-VTMRUAGOSA-NSynonyms
(6aR6bS9aR10S)benzhydryl8(2methyl4nitrophenyl)79dioxo6b7899a10hexahydro6aHpyrrolo(3434)pyrrolo(12a)quinoline10carboxylate
CC1=C(C=CC(=C1)(N+)(=O)(O))N2C(=O)C3C4C=CC5=CC=CC=C5N4C(C3C2=O)C(=O)OC(C6=CC=CC=C6)C7=CC=CC=C7
diphenylmethyl(6aR6bS9aR10S)8(2methyl4nitrophenyl)79dioxo6b7899a10hexahydro6aHpyrrolo(3434)pyrrolo(12a)quinoline10carboxylate
InChI=1SC35H27N3O6c1212025(38(42)43)171926(21)3733(39)292818162210891527(22)36(28)31(30(29)34(37)40)35(41)4432(23114251223)24136371424h2202832H1H3t28293031+m1s1
MFCD18242139
O=C((C@H)1N2(C@@H)((C@@H)3(C@H)1C(=O)N(C3=O)c1ccc(cc1C)(N+)(=O)(O))C=Cc1c2cccc1)OC(c1ccccc1)c1ccccc1
ZINC000102437684
ZINC102437684
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.