Vitas-M small molecule compound
7-chloro-6'-hydroxy-5'-(3-hydroxyphenyl)-4,6-dimethoxy-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
STL551042
SMILES COc1cc(OC)c(c2c1C(=O)C1(O2)C(C)CC2=Nc3c(C(C2=C1O)c1cccc(c1)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 C29H26ClN3O8 MW 579.99 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H26ClN3O8/c1-12-9-15-19(24(35)29(12)25(36)20-16(39-4)11-17(40-5)22(30)23(20)41-29)18(13-7-6-8-14(34)10-13)21-26(31-15)32(2)28(38)33(3)27(21)37/h6-8,10-12,18,34-35H,9H2,1-5H3InChIKey
JMRFEJGSNZPXQL-UHFFFAOYSA-NSynonyms
7chloro6hydroxy5(3hydroxyphenyl)46dimethoxy138trimethyl1589tetrahydro2H3Hspiro(1benzofuran27pyrimido(45b)quinoline)234(3H)trione
InChI=1SC29H26ClN3O8c11291519(24(35)29(12)25(36)2016(394)1117(405)22(30)23(20)4129)18(1376814(34)1013)2126(3115)32(2)28(38)33(3)27(21)37h681012183435H9H215H3
MFCD31757913
ZINC000888089812
ZINC000888089815
Check stock
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Check stock on Vitas-MAvailable files
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