Vitas-M small molecule compound
(8S,8aR,11aS,11bS)-10-(4-nitrophenyl)-8-(phenylcarbonyl)-11a,11b-dihydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]isoquinoline-9,11(8aH,10H)-dione
Catalog ID
STK557260
SMILES O=C([C@@H]1[C@@H]2C(=O)N(C(=O)[C@@H]2[C@@H]2N1C=Cc1c2cccc1)c1ccc(cc1)[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 C27H19N3O5 MW 465.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H19N3O5/c31-25(17-7-2-1-3-8-17)24-22-21(23-20-9-5-4-6-16(20)14-15-28(23)24)26(32)29(27(22)33)18-10-12-19(13-11-18)30(34)35/h1-15,21-24H/t21-,22+,23+,24-/m0/s1InChIKey
PEMXMCGQBYVHHF-KEZOAJOQSA-NSynonyms
1013792-95-4(8S8aR11aS11bS)10(4nitrophenyl)8(phenylcarbonyl)11a11bdihydro8Hpyrrolo(3434)pyrrolo(21a)isoquinoline911(8aH10H)dione
(8S8aR11aS11bS)8benzoyl10(4nitrophenyl)11a11bdihydro8Hpyrrolo(3434)pyrrolo(21a)isoquinoline911(8aH10H)dione
1013792954
C1=CC=C(C=C1)C(=O)C2C3C(C4N2C=CC5=CC=CC=C45)C(=O)N(C3=O)C6=CC=C(C=C6)(N+)(=O)(O)
InChI=1SC27H19N3O5c3125(177213817)242221(2320954616(20)141528(23)24)26(32)29(27(22)33)18101219(131118)30(34)35h1152124Ht2122+23+24m0s1
MFCD18242993
O=C((C@@H)1(C@@H)2C(=O)N(C(=O)(C@@H)2(C@@H)2N1C=Cc1c2cccc1)c1ccc(cc1)(N+)(=O)(O))c1ccccc1
ZINC000015987041
ZINC15987041
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.