Vitas-M small molecule compound
(2S,3R)-methyl 2-(1-(3,4-dimethoxyphenyl)-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline-2-carboxamido)-3-methylpentanoate
Catalog ID
STL534767
SMILES CCC([C@@H](C(=O)OC)NC(=O)N1CCc2c(C1c1ccc(c(c1)OC)OC)cc(c(c2)OC)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 C27H36N2O7 MW 500.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H36N2O7/c1-8-16(2)24(26(30)36-7)28-27(31)29-12-11-17-13-22(34-5)23(35-6)15-19(17)25(29)18-9-10-20(32-3)21(14-18)33-4/h9-10,13-16,24-25H,8,11-12H2,1-7H3,(H,28,31)/t16?,24-,25?/m0/s1InChIKey
XSKNTWZNGHYQNJ-LGHKQPAUSA-NSynonyms
956951-85-2(2S3R)methyl2(1(34dimethoxyphenyl)67dimethoxy1234tetrahydroisoquinoline2carboxamido)3methylpentanoate
16407583
956951852
CCC((C@@H)(C(=O)OC)NC(=O)N1CCc2c(C1c1ccc(c(c1)OC)OC)cc(c(c2)OC)OC)C
InChI=1SC27H36N2O7c1816(2)24(26(30)367)2827(31)291211171322(345)23(356)1519(17)25(29)1891020(323)21(1418)334h91013162425H81112H217H3(H2831)t16?2425?m0s1
methyl(2~(S))2((1(34dimethoxyphenyl)67dimethoxy34dihydro1~(H)isoquinoline2carbonyl)amino)3methylpentanoate
ZINC000008879188
ZINC000012891338
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