Vitas-M small molecule compound
tert-butyl (8R,8aS,11aR)-10-(4-nitrophenyl)-9,11-dioxo-8a,9,10,11,11a,11b-hexahydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]phthalazine-8-carboxylate
Catalog ID
STK550686
SMILES O=C([C@H]1[C@H]2C(=O)N(C(=O)[C@H]2C2N1N=Cc1c2cccc1)c1ccc(cc1)[N+](=O)[O-])OC(C)(C)C
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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 C24H22N4O6 MW 462.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H22N4O6/c1-24(2,3)34-23(31)20-18-17(19-16-7-5-4-6-13(16)12-25-27(19)20)21(29)26(22(18)30)14-8-10-15(11-9-14)28(32)33/h4-12,17-20H,1-3H3/t17-,18+,19?,20-/m1/s1InChIKey
POYPEZVXDGKWNN-JIRNRHONSA-NSynonyms
1014061-73-4(8R8aS11aR)tertbutyl10(4nitrophenyl)911dioxo8a9101111a11bhexahydro8Hpyrrolo(3434)pyrrolo(21a)phthalazine8carboxylate
1014061734
CC(C)(C)OC(=O)C1C2C(C3N1N=CC4=CC=CC=C34)C(=O)N(C2=O)C5=CC=C(C=C5)(N+)(=O)(O)
InChI=1SC24H22N4O6c124(23)3423(31)201817(1916754613(16)122527(19)20)21(29)26(22(18)30)1481015(11914)28(32)33h4121720H13H3t1718+19?20m1s1
MFCD18242537
O=C((C@H)1(C@H)2C(=O)N(C(=O)(C@H)2C2N1N=Cc1c2cccc1)c1ccc(cc1)(N+)(=O)(O))OC(C)(C)C
tertbutyl(8R8aS11aR)10(4nitrophenyl)911dioxo8a9101111a11bhexahydro8Hpyrrolo(3434)pyrrolo(21a)phthalazine8carboxylate
ZINC000009428473
ZINC000009428474
Check stock
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Check stock on Vitas-MAvailable files
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