Vitas-M small molecule compound
[4-(7-chloro-6'-hydroxy-4,6-dimethoxy-1',3',8'-trimethyl-2',3,4'-trioxo-1',3',4',5',8',9'-hexahydro-2'H,3H-spiro[1-benzofuran-2,7'-pyrimido[4,5-b]quinolin]-5'-yl)-2-methoxyphenoxy]acetic acid
Catalog ID
STL549589
SMILES COc1cc(ccc1OCC(=O)O)C1c2c(=O)n(C)c(=O)n(c2N=C2C1=C(O)C1(C(C2)C)Oc2c(C1=O)c(OC)cc(c2Cl)OC)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 C32H30ClN3O11 MW 668.06 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H30ClN3O11/c1-13-9-15-22(27(39)32(13)28(40)23-18(44-5)11-19(45-6)25(33)26(23)47-32)21(24-29(34-15)35(2)31(42)36(3)30(24)41)14-7-8-16(17(10-14)43-4)46-12-20(37)38/h7-8,10-11,13,21,39H,9,12H2,1-6H3,(H,37,38)InChIKey
GEJZNWPFJHQPBU-UHFFFAOYSA-NSynonyms
(4(7chloro6hydroxy46dimethoxy138trimethyl234trioxo134589hexahydro2H3Hspiro(1benzofuran27pyrimido(45b)quinolin)5yl)2methoxyphenoxy)aceticacid
InChI=1SC32H30ClN3O11c11391522(27(39)32(13)28(40)2318(445)1119(456)25(33)26(23)4732)21(2429(3415)35(2)31(42)36(3)30(24)41)147816(17(1014)434)461220(37)38h781011132139H912H216H3(H3738)
MFCD31757075
ZINC000888089058
ZINC000888089061
Check stock
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