Vitas-M small molecule compound

7-chloro-6'-hydroxy-4,6-dimethoxy-1',3',8'-trimethyl-5'-[4-(propan-2-yl)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
STL550425
SMILES COc1cc(OC)c(c2c1C(=O)C1(O2)C(C)CC2=Nc3c(C(C2=C1O)c1ccc(cc1)C(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 C32H32ClN3O7 MW 606.07 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H32ClN3O7/c1-14(2)16-8-10-17(11-9-16)21-22-18(34-29-24(21)30(39)36(5)31(40)35(29)4)12-15(3)32(27(22)37)28(38)23-19(41-6)13-20(42-7)25(33)26(23)43-32/h8-11,13-15,21,37H,12H2,1-7H3
InChIKey
HTFXINVAJQNGLA-UHFFFAOYSA-N
Synonyms

7chloro6hydroxy46dimethoxy138trimethyl5(4(propan2yl)phenyl)1589tetrahydro2H3Hspiro(1benzofuran27pyrimido(45b)quinoline)234(3H)trione
InChI=1SC32H32ClN3O7c114(2)1681017(11916)212218(342924(21)30(39)36(5)31(40)35(29)4)1215(3)32(27(22)37)28(38)2319(416)1320(427)25(33)26(23)4332h81113152137H12H217H3
MFCD31757584
ZINC000888090540
ZINC000888090543

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Available files

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