Vitas-M small molecule compound
(12aS)-6-(3-nitrophenyl)-2-(2-phenylethyl)-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Catalog ID
STL457905
SMILES O=C1CN(CCc2ccccc2)C(=O)[C@H]2N1C(c1cccc(c1)[N+](=O)[O-])c1c(C2)c2c([nH]1)cccc2
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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 C28H24N4O4 MW 480.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H24N4O4/c33-25-17-30(14-13-18-7-2-1-3-8-18)28(34)24-16-22-21-11-4-5-12-23(21)29-26(22)27(31(24)25)19-9-6-10-20(15-19)32(35)36/h1-12,15,24,27,29H,13-14,16-17H2/t24-,27?/m0/s1InChIKey
GLDJKNDPHNRWJW-BXXZMZEQSA-NSynonyms
956993-46-7(12aS)6(3nitrophenyl)2(2phenylethyl)23671212ahexahydropyrazino(1216)pyrido(34b)indole14dione
(12aS)6(3nitrophenyl)2phenethyl231212atetrahydropyrazino(1216)pyrido(34b)indole14(6H7H)dione
(12aS)6(3nitrophenyl)2phenethyl671212atetrahydro3Hpyrazino(12b)$bcarboline14quinone
956993467
C1C2C(=O)N(CC(=O)N2C(C3=C1C4=CC=CC=C4N3)C5=CC(=CC=C5)(N+)(=O)(O))CCC6=CC=CC=C6
InChI=1SC28H24N4O4c33251730(1413187213818)28(34)2416222111451223(21)2926(22)27(31(24)25)19961020(1519)32(35)36h11215242729H13141617H2t2427?m0s1
MFCD03660465
O=C1CN(CCc2ccccc2)C(=O)(C@H)2N1C(c1cccc(c1)(N+)(=O)(O))c1c(C2)c2c((nH)1)cccc2
ZINC000002091537
ZINC000002091539
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.