Vitas-M small molecule compound
4-methoxybenzyl 2,7,7-trimethyl-4-(5-methylfuran-2-yl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK010285
SMILES COc1ccc(cc1)COC(=O)C1=C(C)NC2=C(C1c1ccc(o1)C)C(=O)CC(C2)(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 C26H29NO5 MW 435.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H29NO5/c1-15-6-11-21(32-15)24-22(25(29)31-14-17-7-9-18(30-5)10-8-17)16(2)27-19-12-26(3,4)13-20(28)23(19)24/h6-11,24,27H,12-14H2,1-5H3InChIKey
XRQZDPSRFVTDLH-UHFFFAOYSA-NSynonyms
5806-53-1(4methoxyphenyl)methyl277trimethyl4(5methylfuran2yl)5oxo1468tetrahydroquinoline3carboxylate
4methoxybenzyl277trimethyl4(5methylfuran2yl)5oxo145678hexahydroquinoline3carboxylate
5806531
CC1=CC=C(O1)C2C3=C(CC(CC3=O)(C)C)NC(=C2C(=O)OCC4=CC=C(C=C4)OC)C
COc1ccc(cc1)COC(=O)C1=C(C)NC2=C(C1c1ccc(o1)C)C(=O)CC(C2)(C)C
InChI=1SC26H29NO5c11561121(3215)2422(25(29)3114177918(305)10817)16(2)27191226(34)1320(28)23(19)24h6112427H1214H215H3
MFCD02188066
STK010285
ZINC000006407796
ZINC000006407861
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