Vitas-M small molecule compound
methyl 7-chloro-4'-(2-hydroxy-7-methoxyquinolin-3-yl)-4,6-dimethoxy-2',7'-dimethyl-3,5'-dioxo-1',5',7',8'-tetrahydro-3H,4'H-spiro[1-benzofuran-2,6'-quinoline]-3'-carboxylate
Catalog ID
STL550103
SMILES COc1ccc2c(c1)nc(c(c2)C1C(=C(C)NC2=C1C(=O)C1(C(C2)C)Oc2c(C1=O)c(OC)cc(c2Cl)OC)C(=O)OC)O
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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 C32H29ClN2O9 MW 621.04 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H29ClN2O9/c1-13-9-19-24(28(36)32(13)29(37)25-20(41-4)12-21(42-5)26(33)27(25)44-32)23(22(14(2)34-19)31(39)43-6)17-10-15-7-8-16(40-3)11-18(15)35-30(17)38/h7-8,10-13,23,34H,9H2,1-6H3,(H,35,38)InChIKey
UQEKLSYKAWIKQR-UHFFFAOYSA-NSynonyms
132286238
InChI=1SC32H29ClN2O9c11391924(28(36)32(13)29(37)2520(414)1221(425)26(33)27(25)4432)23(22(14(2)3419)31(39)436)1710157816(403)1118(15)3530(17)38h7810132334H9H216H3(H3538)
methyl7chloro4(2hydroxy7methoxyquinolin3yl)46dimethoxy27dimethyl35dioxo1578tetrahydro3H4Hspiro(1benzofuran26quinoline)3carboxylate
methyl7chloro46dimethoxy4(7methoxy2oxo1~(H)quinolin3yl)27dimethyl35dioxospiro(1478tetrahydroquinoline621benzofuran)3carboxylate
MFCD31757396
ZINC000888089990
ZINC000888089993
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