Vitas-M small molecule compound
(8S,8aR,11aS,11bS)-10-(2-methyl-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
STK555146
SMILES O=C([C@@H]1[C@@H]2C(=O)N(C(=O)[C@@H]2[C@@H]2N1C=Cc1c2cccc1)c1ccc(cc1C)[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 C28H21N3O5 MW 479.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H21N3O5/c1-16-15-19(31(35)36)11-12-21(16)30-27(33)22-23(28(30)34)25(26(32)18-8-3-2-4-9-18)29-14-13-17-7-5-6-10-20(17)24(22)29/h2-15,22-25H,1H3/t22-,23+,24+,25-/m0/s1InChIKey
AQFFXOYAXIQCIY-LIONHTAISA-NSynonyms
1014082-36-0(8S8aR11aS11bS)10(2methyl4nitrophenyl)8(phenylcarbonyl)11a11bdihydro8Hpyrrolo(3434)pyrrolo(21a)isoquinoline911(8aH10H)dione
(8S8aR11aS11bS)8benzoyl10(2methyl4nitrophenyl)11a11bdihydro8Hpyrrolo(3434)pyrrolo(21a)isoquinoline911(8aH10H)dione
1014082360
CC1=C(C=CC(=C1)(N+)(=O)(O))N2C(=O)C3C(C2=O)C(N4C3C5=CC=CC=C5C=C4)C(=O)C6=CC=CC=C6
InChI=1SC28H21N3O5c1161519(31(35)36)111221(16)3027(33)2223(28(30)34)25(26(32)188324918)291413177561020(17)24(22)29h2152225H1H3t2223+24+25m0s1
MFCD18242845
O=C((C@@H)1(C@@H)2C(=O)N(C(=O)(C@@H)2(C@@H)2N1C=Cc1c2cccc1)c1ccc(cc1C)(N+)(=O)(O))c1ccccc1
ZINC000016039387
ZINC16039387
Check stock
See real-time availability and sample size for STK555146 on the Vitas-M platform.
Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.