Vitas-M small molecule compound
(3S)-2-[(2-hydroxy-4-oxoquinazolin-3(4H)-yl)acetyl]-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid
Catalog ID
STL534530
SMILES COc1cc2CN(C(=O)Cn3c(O)nc4c(c3=O)cccc4)[C@@H](Cc2cc1OC)C(=O)O
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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 C22H21N3O7 MW 439.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21N3O7/c1-31-17-8-12-7-16(21(28)29)24(10-13(12)9-18(17)32-2)19(26)11-25-20(27)14-5-3-4-6-15(14)23-22(25)30/h3-6,8-9,16H,7,10-11H2,1-2H3,(H,23,30)(H,28,29)/t16-/m0/s1InChIKey
RVHDHUPSFAAQNR-INIZCTEOSA-NSynonyms
956912-54-2(3~(S))2(2(24dioxo1~(H)quinazolin3yl)acetyl)67dimethoxy34dihydro1~(H)isoquinoline3carboxylicacid
(3S)2((2hydroxy4oxoquinazolin3(4H)yl)acetyl)67dimethoxy1234tetrahydroisoquinoline3carboxylicacid
16407758
956912542
InChI=1SC22H21N3O7c13117812716(21(28)29)24(1013(12)918(17)322)19(26)112520(27)14534615(14)2322(25)30h368916H71011H212H3(H2330)(H2829)t16m0s1
ZINC000008879795
ZINC8879795
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