Vitas-M small molecule compound
(2S,7'R)-7-chloro-4'-(3,4-dimethoxyphenyl)-4,6-dimethoxy-7'-methyl-3',4',7',8'-tetrahydro-2'H,3H-spiro[1-benzofuran-2,6'-quinoline]-2',3,5'(1'H)-trione
Catalog ID
STL549526
SMILES COc1cc(ccc1OC)C1CC(=O)NC2=C1C(=O)[C@]1([C@@H](C2)C)Oc2c(C1=O)c(OC)cc(c2Cl)OC
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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 C27H26ClNO8 MW 527.96 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H26ClNO8/c1-12-8-15-21(14(10-20(30)29-15)13-6-7-16(33-2)17(9-13)34-3)25(31)27(12)26(32)22-18(35-4)11-19(36-5)23(28)24(22)37-27/h6-7,9,11-12,14H,8,10H2,1-5H3,(H,29,30)/t12-,14?,27+/m1/s1InChIKey
UNLIKDUXSSCWIM-UYWAQXBHSA-NSynonyms
(2~(S)7~(R))7chloro4(34dimethoxyphenyl)46dimethoxy7methylspiro(1benzofuran263478tetrahydro1~(H)quinoline)235trione
(2S7R)7chloro4(34dimethoxyphenyl)46dimethoxy7methyl3478tetrahydro1H3Hspiro(benzofuran26quinoline)235trione
(2S7R)7chloro4(34dimethoxyphenyl)46dimethoxy7methyl3478tetrahydro2H3Hspiro(1benzofuran26quinoline)235(1H)trione
129894839
COc1cc(ccc1OC)C1CC(=O)NC2=C1C(=O)(C@)1((C@@H)(C2)C)Oc2c(C1=O)c(OC)cc(c2Cl)OC
InChI=1SC27H26ClNO8c11281521(14(1020(30)2915)136716(332)17(913)343)25(31)27(12)26(32)2218(354)1119(365)23(28)24(22)3727h679111214H810H215H3(H2930)t1214?27+m1s1
ZINC000524729450
ZINC000524729451
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