Vitas-M small molecule compound
(1'S,3R,3'S,7a'S)-5''-fluoro-1'-[(3-nitrophenyl)carbonyl]-5',6',7',7a'-tetrahydro-1'H-dispiro[indole-3,2'-pyrrolizine-3',3''-indole]-2,2''(1H,1''H)-dione
Catalog ID
STK586237
SMILES Fc1ccc2c(c1)[C@]1(C(=O)N2)N2CCC[C@H]2[C@H]([C@@]21C(=O)Nc1c2cccc1)C(=O)c1cccc(c1)[N+](=O)[O-]
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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 C28H21FN4O5 MW 512.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H21FN4O5/c29-16-10-11-21-19(14-16)28(26(36)31-21)27(18-7-1-2-8-20(18)30-25(27)35)23(22-9-4-12-32(22)28)24(34)15-5-3-6-17(13-15)33(37)38/h1-3,5-8,10-11,13-14,22-23H,4,9,12H2,(H,30,35)(H,31,36)/t22-,23-,27+,28+/m0/s1InChIKey
JFQBHQHEJPOBSJ-WLGONLEPSA-NSynonyms
1014023-27-8(1S3R3S7aS)5fluoro1((3nitrophenyl)carbonyl)11225677aoctahydro1Hdispiro(indole32pyrrolizine33indole)22dione
(1S3R3S7aS)5fluoro1((3nitrophenyl)carbonyl)5677atetrahydro1Hdispiro(indole32pyrrolizine33indole)22(1H1H)dione
1014023278
C1CC2C(C3(C4=CC=CC=C4NC3=O)C5(N2C1)C6=C(C=CC(=C6)F)NC5=O)C(=O)C7=CC(=CC=C7)(N+)(=O)(O)
Fc1ccc2c(c1)(C@)1(C(=O)N2)N2CCC(C@H)2(C@H)((C@@)21C(=O)Nc1c2cccc1)C(=O)c1cccc(c1)(N+)(=O)(O)
InChI=1SC28H21FN4O5c291610112119(1416)28(26(36)3121)27(18712820(18)3025(27)35)23(22941232(22)28)24(34)1553617(1315)33(37)38h1358101113142223H4912H2(H3035)(H3136)t222327+28+m0s1
ZINC000049741681
ZINC49741681
Check stock
See real-time availability and sample size for STK586237 on the Vitas-M platform.
Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.