Vitas-M small molecule compound
(2S,3R)-2-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline-2-carboxamido)-3-methylpentanoic acid
Catalog ID
STL547492
SMILES CCC([C@@H](C(=O)O)NC(=O)N1CCc2c(C1)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 C18H26N2O5 MW 350.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H26N2O5/c1-5-11(2)16(17(21)22)19-18(23)20-7-6-12-8-14(24-3)15(25-4)9-13(12)10-20/h8-9,11,16H,5-7,10H2,1-4H3,(H,19,23)(H,21,22)/t11?,16-/m0/s1InChIKey
XFRFANNACSSJLF-NBFOKTCDSA-NSynonyms
956952-61-7(2~(S))2((67dimethoxy34dihydro1~(H)isoquinoline2carbonyl)amino)3methylpentanoicacid
(2S3R)2(67dimethoxy1234tetrahydroisoquinoline2carboxamido)3methylpentanoicacid
16408547
956952617
CCC((C@@H)(C(=O)O)NC(=O)N1CCc2c(C1)cc(c(c2)OC)OC)C
InChI=1SC18H26N2O5c1511(2)16(17(21)22)1918(23)207612814(243)15(254)913(12)1020h891116H5710H214H3(H1923)(H2122)t11?16m0s1
ZINC000012896976
ZINC000012896980
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