Vitas-M small molecule compound
(6aR,6bS,9aR,10S)-10-(furan-2-ylcarbonyl)-8-(3-nitrophenyl)-9a,10-dihydro-6aH-pyrrolo[3',4':3,4]pyrrolo[1,2-a]quinoline-7,9(6bH,8H)-dione
Catalog ID
STK557093
SMILES O=C1N(c2cccc(c2)[N+](=O)[O-])C(=O)[C@@H]2[C@H]1[C@H]1C=Cc3c(N1[C@@H]2C(=O)c1ccco1)cccc3
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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 C25H17N3O6 MW 455.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H17N3O6/c29-23(19-9-4-12-34-19)22-21-20(18-11-10-14-5-1-2-8-17(14)27(18)22)24(30)26(25(21)31)15-6-3-7-16(13-15)28(32)33/h1-13,18,20-22H/t18-,20-,21-,22+/m1/s1InChIKey
XLHBWNLYYZPSFT-NMIHRBCNSA-NSynonyms
1013757-79-3(6aR6bS9aR10S)10(furan2carbonyl)8(3nitrophenyl)9a10dihydro6aHpyrrolo(3434)pyrrolo(12a)quinoline79(6bH8H)dione
(6aR6bS9aR10S)10(furan2ylcarbonyl)8(3nitrophenyl)9a10dihydro6aHpyrrolo(3434)pyrrolo(12a)quinoline79(6bH8H)dione
1013757793
C1=CC=C2C(=C1)C=CC3N2C(C4C3C(=O)N(C4=O)C5=CC(=CC=C5)(N+)(=O)(O))C(=O)C6=CC=CO6
InChI=1SC25H17N3O6c2923(1994123419)222120(18111014512817(14)27(18)22)24(30)26(25(21)31)1563716(1315)28(32)33h113182022Ht18202122+m1s1
MFCD18242984
O=C1N(c2cccc(c2)(N+)(=O)(O))C(=O)(C@@H)2(C@H)1(C@H)1C=Cc3c(N1(C@@H)2C(=O)c1ccco1)cccc3
ZINC000009424258
ZINC09424258
ZINC9424258
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.