Vitas-M small molecule compound
(8S,8aR,11aS)-10-(4-fluorophenyl)-8-[(3-nitrophenyl)carbonyl]-11a,11b-dihydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]isoquinoline-9,11(8aH,10H)-dione
Catalog ID
STK547920
SMILES Fc1ccc(cc1)N1C(=O)[C@@H]2[C@H](C1=O)C1N([C@@H]2C(=O)c2cccc(c2)[N+](=O)[O-])C=Cc2c1cccc2
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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 C27H18FN3O5 MW 483.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H18FN3O5/c28-17-8-10-18(11-9-17)30-26(33)21-22(27(30)34)24(25(32)16-5-3-6-19(14-16)31(35)36)29-13-12-15-4-1-2-7-20(15)23(21)29/h1-14,21-24H/t21-,22+,23?,24-/m0/s1InChIKey
IPWIVXRFWXSEAS-UZLDWMDBSA-NSynonyms
956824-97-8(8S8aR11aS)10(4fluorophenyl)8((3nitrophenyl)carbonyl)11a11bdihydro8Hpyrrolo(3434)pyrrolo(21a)isoquinoline911(8aH10H)dione
(8S8aR11aS)10(4fluorophenyl)8(3nitrobenzoyl)11a11bdihydro8Hpyrrolo(3434)pyrrolo(21a)isoquinoline911(8aH10H)dione
956824978
C1=CC=C2C3C4C(C(N3C=CC2=C1)C(=O)C5=CC(=CC=C5)(N+)(=O)(O))C(=O)N(C4=O)C6=CC=C(C=C6)F
Fc1ccc(cc1)N1C(=O)(C@@H)2(C@H)(C1=O)C1N((C@@H)2C(=O)c2cccc(c2)(N+)(=O)(O))C=Cc2c1cccc2
InChI=1SC27H18FN3O5c281781018(11917)3026(33)2122(27(30)34)24(25(32)1653619(1416)31(35)36)29131215412720(15)23(21)29h1142124Ht2122+23?24m0s1
MFCD18242382
ZINC000016037723
ZINC000020082675
Check stock
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Check stock on Vitas-MAvailable files
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