Vitas-M small molecule compound
8-benzyl-10-(2,2-dimethylpropanoyl)-3-methoxy-9a,10-dihydro-6aH-pyrrolo[3',4':3,4]pyrrolo[1,2-a]quinoline-7,9(6bH,8H)-dione
Catalog ID
STL232691
SMILES COc1ccc2c(c1)C=CC1N2C(C2C1C(=O)N(C2=O)Cc1ccccc1)C(=O)C(C)(C)C
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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 C27H28N2O4 MW 444.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H28N2O4/c1-27(2,3)24(30)23-22-21(25(31)28(26(22)32)15-16-8-6-5-7-9-16)20-12-10-17-14-18(33-4)11-13-19(17)29(20)23/h5-14,20-23H,15H2,1-4H3InChIKey
KCGUUCAKPQAXQF-UHFFFAOYSA-NSynonyms
(6bR9aS10R)8benzyl3methoxy10pivaloyl9a10dihydro6aHpyrrolo(3434)pyrrolo(12a)quinoline79(6bH8H)dione
8benzyl10(22dimethylpropanoyl)3methoxy9a10dihydro6aHpyrrolo(3434)pyrrolo(12a)quinoline79(6bH8H)dione
CC(C)(C)C(=O)C1C2C(C3N1C4=C(C=C3)C=C(C=C4)OC)C(=O)N(C2=O)CC5=CC=CC=C5
COc1ccc2c(c1)C=CC1N2(C@H)((C@@H)2(C@H)1C(=O)N(C2=O)Cc1ccccc1)C(=O)C(C)(C)C
InChI=1SC27H28N2O4c127(23)24(30)232221(25(31)28(26(22)32)15168657916)201210171418(334)111319(17)29(20)23h5142023H15H214H3
MFCD24858292
ZINC000002441974
ZINC000248254066
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