Vitas-M small molecule compound
2-(propan-2-yloxy)ethyl 2-methyl-5-oxo-7-(thiophen-2-yl)-4-(3,4,5-trimethoxyphenyl)-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK403138
SMILES COc1c(OC)cc(cc1OC)C1C(=C(C)NC2=C1C(=O)CC(C2)c1cccs1)C(=O)OCCOC(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 C29H35NO7S MW 541.67 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H35NO7S/c1-16(2)36-9-10-37-29(32)25-17(3)30-20-12-18(24-8-7-11-38-24)13-21(31)27(20)26(25)19-14-22(33-4)28(35-6)23(15-19)34-5/h7-8,11,14-16,18,26,30H,9-10,12-13H2,1-6H3InChIKey
LNYUBOYYWHATKN-UHFFFAOYSA-NSynonyms
2(propan2yloxy)ethyl2methyl5oxo7(thiophen2yl)4(345trimethoxyphenyl)145678hexahydroquinoline3carboxylate
2propan2yloxyethyl2methyl5oxo7thiophen2yl4(345trimethoxyphenyl)4678tetrahydro1Hquinoline3carboxylate
CC1=C(C(C2=C(N1)CC(CC2=O)C3=CC=CS3)C4=CC(=C(C(=C4)OC)OC)OC)C(=O)OCCOC(C)C
InChI=1SC29H35NO7Sc116(2)369103729(32)2517(3)30201218(2487113824)1321(31)27(20)26(25)191422(334)28(356)23(1519)345h78111416182630H9101213H216H3
MFCD03371104
ZINC000002771555
ZINC000002771558
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