Vitas-M small molecule compound
4-{[(6aS,6bR,9aS,10R)-8-(2-methyl-4-nitrophenyl)-7,9-dioxo-6b,7,8,9,9a,10-hexahydro-6aH-pyrrolo[3',4':3,4]pyrrolo[1,2-a]quinolin-10-yl]carbonyl}phenyl acetate
Catalog ID
STK549241
SMILES CC(=O)Oc1ccc(cc1)C(=O)[C@@H]1N2[C@H]([C@H]3[C@@H]1C(=O)N(C3=O)c1ccc(cc1C)[N+](=O)[O-])C=Cc1c2cccc1
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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 C30H23N3O7 MW 537.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H23N3O7/c1-16-15-20(33(38)39)10-14-22(16)32-29(36)25-24-13-9-18-5-3-4-6-23(18)31(24)27(26(25)30(32)37)28(35)19-7-11-21(12-8-19)40-17(2)34/h3-15,24-27H,1-2H3/t24-,25-,26-,27+/m0/s1InChIKey
CFIFQVFEOMZXOE-YIPNQBBMSA-NSynonyms
1013751-26-21013751262
4(((6aS6bR9aS10R)8(2methyl4nitrophenyl)79dioxo6b7899a10hexahydro6aHpyrrolo(3434)pyrrolo(12a)quinolin10yl)carbonyl)phenylacetate
4((6aS6bR9aS10R)8(2methyl4nitrophenyl)79dioxo6b7899a10hexahydro6aHpyrrolo(3434)pyrrolo(12a)quinoline10carbonyl)phenylacetate
CC(=O)Oc1ccc(cc1)C(=O)(C@@H)1N2(C@H)((C@H)3(C@@H)1C(=O)N(C3=O)c1ccc(cc1C)(N+)(=O)(O))C=Cc1c2cccc1
CC1=C(C=CC(=C1)(N+)(=O)(O))N2C(=O)C3C4C=CC5=CC=CC=C5N4C(C3C2=O)C(=O)C6=CC=C(C=C6)OC(=O)C
InChI=1SC30H23N3O7c1161520(33(38)39)101422(16)3229(36)252413918534623(18)31(24)27(26(25)30(32)37)28(35)1971121(12819)4017(2)34h3152427H12H3t24252627+m0s1
MFCD18242456
ZINC000100978770
ZINC100978770
Check stock
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Check stock on Vitas-MAvailable files
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