Vitas-M small molecule compound
(2S,3S)-3-hydroxy-2-((S)-2-(1-methyl-2,4-dioxo-1,2-dihydroquinazolin-3(4H)-yl)-3-phenylpropanamido)butanoic acid
Catalog ID
STL562856
SMILES CC([C@@H](C(=O)O)NC(=O)[C@@H](n1c(=O)c2ccccc2n(c1=O)C)Cc1ccccc1)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 C22H23N3O6 MW 425.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H23N3O6/c1-13(26)18(21(29)30)23-19(27)17(12-14-8-4-3-5-9-14)25-20(28)15-10-6-7-11-16(15)24(2)22(25)31/h3-11,13,17-18,26H,12H2,1-2H3,(H,23,27)(H,29,30)/t13?,17-,18-/m0/s1InChIKey
XZQUEDHAINZOCF-RHGDZWTLSA-NSynonyms
956827-32-0(2S)3hydroxy2(((2S)2(1methyl24dioxoquinazolin3yl)3phenylpropanoyl)amino)butanoicacid
(2S3S)3HYDROXY2((S)2(1METHYL24DIOXO12DIHYDROQUINAZOLIN3(4H)YL)3PHENYLPROPANAMIDO)BUTANOICACID
16404987
956827320
CC((C@@H)(C(=O)O)NC(=O)(C@@H)(n1c(=O)c2ccccc2n(c1=O)C)Cc1ccccc1)O
InChI=1SC22H23N3O6c113(26)18(21(29)30)2319(27)17(12148435914)2520(28)1510671116(15)24(2)22(25)31h31113171826H12H212H3(H2327)(H2930)t13?1718m0s1
MFCD06768639
ZINC000012885820
ZINC000012885825
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