Vitas-M small molecule compound
2-[1-(2-hydroxy-4,4-dimethyl-6-oxocyclohex-1-en-1-yl)-4,4,6,8-tetramethyl-2-oxo-1,2-dihydro-4H-pyrrolo[3,2,1-ij]quinolin-1-yl]-5,5-dimethylcyclohexane-1,3-dione
Catalog ID
STL510728
SMILES Cc1cc2C(=CC(N3c2c(c1)C(C1C(=O)CC(CC1=O)(C)C)(C1=C(O)CC(CC1=O)(C)C)C3=O)(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 C31H37NO5 MW 503.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H37NO5/c1-16-9-18-17(2)11-30(7,8)32-26(18)19(10-16)31(27(32)37,24-20(33)12-28(3,4)13-21(24)34)25-22(35)14-29(5,6)15-23(25)36/h9-11,24,35H,12-15H2,1-8H3InChIKey
VUNQMDVNRGYAEB-UHFFFAOYSA-NSynonyms
134717362
2(1(2hydroxy44dimethyl6oxocyclohex1en1yl)4468tetramethyl2oxo12dihydro4Hpyrrolo(321ij)quinolin1yl)55dimethylcyclohexane13dione
2(3(2hydroxy44dimethyl6oxocyclohexen1yl)691111tetramethyl2oxo1azatricyclo(6310^(412))dodeca468(12)9tetraen3yl)55dimethylcyclohexane13dione
InChI=1SC31H37NO5c11691817(2)1130(78)3226(18)19(1016)31(27(32)372420(33)1228(34)1321(24)34)2522(35)1429(56)1523(25)36h9112435H1215H218H3
MFCD31711674
ZINC001554503629
ZINC001554503630
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