Vitas-M small molecule compound
(2S)-({N-[(2R)-2-(2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl)-3-phenylpropanoyl]-L-phenylalanyl}amino)(phenyl)ethanoic acid
Catalog ID
STL531612
SMILES O=C([C@@H](NC(=O)[C@H](n1c(=O)[nH]c2c(c1=O)cccc2)Cc1ccccc1)Cc1ccccc1)N[C@@H](c1ccccc1)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 C34H30N4O6 MW 590.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C34H30N4O6/c39-30(37-29(33(42)43)24-16-8-3-9-17-24)27(20-22-12-4-1-5-13-22)35-31(40)28(21-23-14-6-2-7-15-23)38-32(41)25-18-10-11-19-26(25)36-34(38)44/h1-19,27-29H,20-21H2,(H,35,40)(H,36,44)(H,37,39)(H,42,43)/t27-,28+,29-/m0/s1InChIKey
ATGZZKRQZOQPHH-NHKHRBQYSA-NSynonyms
956950-27-9(2~(S))2(((2~(S))2(((2~(R))2(24dioxo1~(H)quinazolin3yl)3phenylpropanoyl)amino)3phenylpropanoyl)amino)2phenylaceticacid
(2S)((N((2R)2(24dioxo14dihydroquinazolin3(2H)yl)3phenylpropanoyl)Lphenylalanyl)amino)(phenyl)ethanoicacid
(S)2((S)2((R)2(24DIOXO12DIHYDROQUINAZOLIN3(4H)YL)3PHENYLPROPANAMIDO)3PHENYLPROPANAMIDO)2PHENYLACETICACID
16405477
956950279
InChI=1SC34H30N4O6c3930(3729(33(42)43)24168391724)27(2022124151322)3531(40)28(2123146271523)3832(41)251810111926(25)3634(38)44h1192729H2021H2(H3540)(H3644)(H3739)(H4243)t2728+29m0s1
O=C((C@@H)(NC(=O)(C@H)(n1c(=O)(nH)c2c(c1=O)cccc2)Cc1ccccc1)Cc1ccccc1)N(C@@H)(c1ccccc1)C(=O)O
ZINC000070704725
ZINC70704725
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.