Vitas-M small molecule compound
7-chloro-6'-hydroxy-4,6-dimethoxy-5'-[3-methoxy-4-(propan-2-yloxy)phenyl]-1',3',8'-trimethyl-1',5',8',9'-tetrahydro-2'H,3H-spiro[1-benzofuran-2,7'-pyrimido[4,5-b]quinoline]-2',3,4'(3'H)-trione
Catalog ID
STL550254
SMILES COc1cc(OC)c(c2c1C(=O)C1(O2)C(C)CC2=Nc3c(C(C2=C1O)c1ccc(c(c1)OC)OC(C)C)c(=O)n(c(=O)n3C)C)Cl
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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 C33H34ClN3O9 MW 652.10 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H34ClN3O9/c1-14(2)45-18-10-9-16(12-19(18)42-6)22-23-17(35-30-25(22)31(40)37(5)32(41)36(30)4)11-15(3)33(28(23)38)29(39)24-20(43-7)13-21(44-8)26(34)27(24)46-33/h9-10,12-15,22,38H,11H2,1-8H3InChIKey
FSDRXANPOLOOTH-UHFFFAOYSA-NSynonyms
7chloro6hydroxy46dimethoxy5(3methoxy4(propan2yloxy)phenyl)138trimethyl1589tetrahydro2H3Hspiro(1benzofuran27pyrimido(45b)quinoline)234(3H)trione
InChI=1SC33H34ClN3O9c114(2)451810916(1219(18)426)222317(353025(22)31(40)37(5)32(41)36(30)4)1115(3)33(28(23)38)29(39)2420(437)1321(448)26(34)27(24)4633h91012152238H11H218H3
MFCD31757481
ZINC000888090148
ZINC000888090151
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