Vitas-M small molecule compound
(2S,8'R)-7-chloro-4,6-dimethoxy-1',8'-dimethyl-3'-[(2,2,8-trimethyl-4H-[1,3]dioxino[4,5-c]pyridin-5-yl)methyl]-8',9'-dihydro-2'H,3H-spiro[1-benzofuran-2,7'-pyrimido[4,5-b]quinoline]-2',3,4',6'(1'H,3'H)-tetrone
Catalog ID
STL561580
SMILES COc1cc(OC)c(c2c1C(=O)[C@]1(O2)[C@H](C)Cc2c(C1=O)cc1c(n2)n(C)c(=O)n(c1=O)Cc1cnc(c2c1COC(O2)(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 C33H31ClN4O9 MW 663.08 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H31ClN4O9/c1-14-8-20-17(27(39)33(14)28(40)23-21(43-6)10-22(44-7)24(34)26(23)47-33)9-18-29(36-20)37(5)31(42)38(30(18)41)12-16-11-35-15(2)25-19(16)13-45-32(3,4)46-25/h9-11,14H,8,12-13H2,1-7H3/t14-,33+/m1/s1InChIKey
VBAMTZWOOICROF-GSLRCMBYSA-NSynonyms
(2S8R)7chloro46dimethoxy18dimethyl3((228trimethyl4H(13)dioxino(45c)pyridin5yl)methyl)89dihydro1H3Hspiro(benzofuran27pyrimido(45b)quinoline)2346(3H)tetraone
(2S8R)7chloro46dimethoxy18dimethyl3((228trimethyl4H(13)dioxino(45c)pyridin5yl)methyl)89dihydro2H3Hspiro(1benzofuran27pyrimido(45b)quinoline)2346(1H3H)tetrone
(2S8R)7chloro46dimethoxy18dimethyl3((228trimethyl4H(13)dioxino(45c)pyridin5yl)methyl)spiro(1benzofuran2789dihydropyrimido(45b)quinoline)2346tetrone
145704937
COc1cc(OC)c(c2c1C(=O)(C@)1(O2)(C@H)(C)Cc2c(C1=O)cc1c(n2)n(C)c(=O)n(c1=O)Cc1cnc(c2c1COC(O2)(C)C)C)Cl
InChI=1SC33H31ClN4O9c11482017(27(39)33(14)28(40)2321(436)1022(447)24(34)26(23)4733)91829(3620)37(5)31(42)38(30(18)41)1216113515(2)2519(16)134532(34)4625h91114H81213H217H3t1433+m1s1
MFCD32650645
ZINC001848443088
Check stock
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