Vitas-M small molecule compound
2'-(1,3-benzodioxol-5-ylcarbonyl)-1'-(3-nitrophenyl)-1',2',5',6',7',7a'-hexahydrospiro[indole-3,3'-pyrrolizin]-2(1H)-one
Catalog ID
STK725045
SMILES O=C(C1C(c2cccc(c2)[N+](=O)[O-])C2N(C31C(=O)Nc1c3cccc1)CCC2)c1ccc2c(c1)OCO2
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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 C28H23N3O6 MW 497.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H23N3O6/c32-26(17-10-11-22-23(14-17)37-15-36-22)25-24(16-5-3-6-18(13-16)31(34)35)21-9-4-12-30(21)28(25)19-7-1-2-8-20(19)29-27(28)33/h1-3,5-8,10-11,13-14,21,24-25H,4,9,12,15H2,(H,29,33)InChIKey
DNHIPCVCHGGQRF-UHFFFAOYSA-NSynonyms
(1S2R7aS)2(benzo(d)(13)dioxole5carbonyl)1(3nitrophenyl)125677ahexahydrospiro(indoline33pyrrolizin)2one
2(13benzodioxol5ylcarbonyl)1(3nitrophenyl)125677ahexahydrospiro(indole33pyrrolizin)2(1H)one
6(13benzodioxole5carbonyl)7(3nitrophenyl)spiro(123678hexahydropyrrolizine531Hindole)2one
C1CC2C(C(C3(N2C1)C4=CC=CC=C4NC3=O)C(=O)C5=CC6=C(C=C5)OCO6)C7=CC(=CC=C7)(N+)(=O)(O)
InChI=1SC28H23N3O6c3226(1710112223(1417)37153622)2524(1653618(1316)31(34)35)21941230(21)28(25)19712820(19)2927(28)33h135810111314212425H491215H2(H2933)
MFCD08289446
O=C(C1(C@@H)(c2cccc(c2)(N+)(=O)(O))C2N((C@)31C(=O)Nc1c3cccc1)CCC2)c1ccc2c(c1)OCO2
O=C(C1C(c2cccc(c2)(N+)(=O)(O))C2N(C31C(=O)Nc1c3cccc1)CCC2)c1ccc2c(c1)OCO2
ZINC000035165693
ZINC000229815969
Check stock
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Check stock on Vitas-MAvailable files
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