Vitas-M small molecule compound
(2S,7'R)-7-chloro-4,6-dimethoxy-7'-methyl-4'-(propan-2-yl)-3',4',7',8'-tetrahydro-2'H,3H-spiro[1-benzofuran-2,6'-quinoline]-2',3,5'(1'H)-trione
Catalog ID
STL551327
SMILES COc1cc(OC)c(c2c1C(=O)[C@]1(O2)[C@H](C)CC2=C(C1=O)C(CC(=O)N2)C(C)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 C22H24ClNO6 MW 433.89 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H24ClNO6/c1-9(2)11-7-15(25)24-12-6-10(3)22(20(26)16(11)12)21(27)17-13(28-4)8-14(29-5)18(23)19(17)30-22/h8-11H,6-7H2,1-5H3,(H,24,25)/t10-,11?,22+/m1/s1InChIKey
DKHIUXSBESTWME-RZGAQFIJSA-NSynonyms
(2~(S)7~(R))7chloro46dimethoxy7methyl4propan2ylspiro(1benzofuran263478tetrahydro1~(H)quinoline)235trione
(2S7R)7chloro46dimethoxy7methyl4(propan2yl)3478tetrahydro2H3Hspiro(1benzofuran26quinoline)235(1H)trione
(2S7R)7chloro4isopropyl46dimethoxy7methyl3478tetrahydro1H3Hspiro(benzofuran26quinoline)235trione
129895501
COc1cc(OC)c(c2c1C(=O)(C@)1(O2)(C@H)(C)CC2=C(C1=O)C(CC(=O)N2)C(C)C)Cl
InChI=1SC22H24ClNO6c19(2)11715(25)2412610(3)22(20(26)16(11)12)21(27)1713(284)814(295)18(23)19(17)3022h811H67H215H3(H2425)t1011?22+m1s1
ZINC000524730952
ZINC000524730953
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