Vitas-M small molecule compound
2-phenoxyethyl 2,7,7-trimethyl-4-(naphthalen-1-yl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK045348
SMILES O=C(C1=C(C)NC2=C(C1c1cccc3c1cccc3)C(=O)CC(C2)(C)C)OCCOc1ccccc1
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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 C31H31NO4 MW 481.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H31NO4/c1-20-27(30(34)36-17-16-35-22-12-5-4-6-13-22)28(24-15-9-11-21-10-7-8-14-23(21)24)29-25(32-20)18-31(2,3)19-26(29)33/h4-15,28,32H,16-19H2,1-3H3InChIKey
GWGOQOOSTNLRAM-UHFFFAOYSA-NSynonyms
2phenoxyethyl277trimethyl4(naphthalen1yl)5oxo145678hexahydroquinoline3carboxylate
2phenoxyethyl277trimethyl4naphthalen1yl5oxo1468tetrahydroquinoline3carboxylate
CC1=C(C(C2=C(N1)CC(CC2=O)(C)C)C3=CC=CC4=CC=CC=C43)C(=O)OCCOC5=CC=CC=C5
InChI=1SC31H31NO4c12027(30(34)3617163522125461322)28(24159112110781423(21)24)2925(3220)1831(23)1926(29)33h4152832H1619H213H3
MFCD01193792
O=C(C1=C(C)NC2=C(C1c1cccc3c1cccc3)C(=O)CC(C2)(C)C)OCCOc1ccccc1
STK045348
ZINC000002758347
ZINC000002758348
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