Vitas-M small molecule compound
4-(phenylcarbonyl)phenyl (6aS,6bR,9aS,10R)-8-(2,4-dichlorophenyl)-7,9-dioxo-6b,7,8,9,9a,10-hexahydro-6aH-pyrrolo[3',4':3,4]pyrrolo[1,2-a]quinoline-10-carboxylate
Catalog ID
STK548725
SMILES O=C([C@H]1[C@@H]2[C@H]([C@H]3N1c1ccccc1C=C3)C(=O)N(C2=O)c1ccc(cc1Cl)Cl)Oc1ccc(cc1)C(=O)c1ccccc1
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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 C34H22Cl2N2O5 MW 609.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C34H22Cl2N2O5/c35-22-13-17-26(24(36)18-22)38-32(40)28-27-16-12-19-6-4-5-9-25(19)37(27)30(29(28)33(38)41)34(42)43-23-14-10-21(11-15-23)31(39)20-7-2-1-3-8-20/h1-18,27-30H/t27-,28-,29-,30+/m0/s1InChIKey
CXXXXKXZQZGMHZ-GCXHJFECSA-NSynonyms
(6aS6bR9aS10R)4benzoylphenyl8(24dichlorophenyl)79dioxo6b7899a10hexahydro6aHpyrrolo(3434)pyrrolo(12a)quinoline10carboxylate
4(phenylcarbonyl)phenyl(6aS6bR9aS10R)8(24dichlorophenyl)79dioxo6b7899a10hexahydro6aHpyrrolo(3434)pyrrolo(12a)quinoline10carboxylate
C1=CC=C(C=C1)C(=O)C2=CC=C(C=C2)OC(=O)C3C4C(C5N3C6=CC=CC=C6C=C5)C(=O)N(C4=O)C7=C(C=C(C=C7)Cl)Cl
InChI=1SC34H22Cl2N2O5c3522131726(24(36)1822)3832(40)2827161219645925(19)37(27)30(29(28)33(38)41)34(42)4323141021(111523)31(39)207213820h1182730Ht27282930+m0s1
MFCD18242438
O=C((C@H)1(C@@H)2(C@H)((C@H)3N1c1ccccc1C=C3)C(=O)N(C2=O)c1ccc(cc1Cl)Cl)Oc1ccc(cc1)C(=O)c1ccccc1
ZINC000102451531
ZINC102451531
Check stock
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Check stock on Vitas-MAvailable files
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