Vitas-M small molecule compound
tetrahydrofuran-2-ylmethyl 7-[4-(dimethylamino)phenyl]-2-methyl-5-oxo-4-(4-oxo-4H-chromen-3-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK406883
SMILES CN(c1ccc(cc1)C1CC(=O)C2=C(C1)NC(=C(C2c1coc2c(c1=O)cccc2)C(=O)OCC1CCCO1)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 C33H34N2O6 MW 554.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H34N2O6/c1-19-29(33(38)41-17-23-7-6-14-39-23)30(25-18-40-28-9-5-4-8-24(28)32(25)37)31-26(34-19)15-21(16-27(31)36)20-10-12-22(13-11-20)35(2)3/h4-5,8-13,18,21,23,30,34H,6-7,14-17H2,1-3H3InChIKey
HYFXZYZHDVOXOP-UHFFFAOYSA-NSynonyms
CC1=C(C(C2=C(N1)CC(CC2=O)C3=CC=C(C=C3)N(C)C)C4=COC5=CC=CC=C5C4=O)C(=O)OCC6CCCO6
InChI=1SC33H34N2O6c11929(33(38)41172376143923)30(25184028954824(28)32(25)37)3126(3419)1521(1627(31)36)20101222(131120)35(2)3h458131821233034H671417H213H3
MFCD06000340
oxolan2ylmethyl7(4(dimethylamino)phenyl)2methyl5oxo4(4oxochromen3yl)4678tetrahydro1Hquinoline3carboxylate
tetrahydrofuran2ylmethyl7(4(dimethylamino)phenyl)2methyl5oxo4(4oxo4Hchromen3yl)145678hexahydroquinoline3carboxylate
ZINC000001074832
ZINC000059612337
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