Vitas-M small molecule compound
7-chloro-6'-hydroxy-4,6-dimethoxy-1',3',8'-trimethyl-5'-{4-[2-(2-oxopyrrolidin-1-yl)ethoxy]phenyl}-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
STL550351
SMILES COc1cc(OC)c(c2c1C(=O)C1(O2)C(C)CC2=Nc3c(C(C2=C1O)c1ccc(cc1)OCCN1CCCC1=O)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 C35H35ClN4O9 MW 691.14 g/mol Purity >90% as per NMR
InChI
InChI=1S/C35H35ClN4O9/c1-17-15-20-25(30(42)35(17)31(43)26-21(46-4)16-22(47-5)28(36)29(26)49-35)24(27-32(37-20)38(2)34(45)39(3)33(27)44)18-8-10-19(11-9-18)48-14-13-40-12-6-7-23(40)41/h8-11,16-17,24,42H,6-7,12-15H2,1-5H3InChIKey
ROYZEVDAOUZXPT-UHFFFAOYSA-NSynonyms
7chloro6hydroxy46dimethoxy138trimethyl5(4(2(2oxopyrrolidin1yl)ethoxy)phenyl)1589tetrahydro2H3Hspiro(1benzofuran27pyrimido(45b)quinoline)234(3H)trione
InChI=1SC35H35ClN4O9c117152025(30(42)35(17)31(43)2621(464)1622(475)28(36)29(26)4935)24(2732(3720)38(2)34(45)39(3)33(27)44)1881019(11918)48141340126723(40)41h81116172442H671215H215H3
MFCD31757541
ZINC000888088800
ZINC000888088803
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