Vitas-M small molecule compound
(2S,3R)-2-((S)-4-amino-2-((S)-2-(2-hydroxy-4-oxoquinazolin-3(4H)-yl)-3-phenylpropanamido)-4-oxobutanamido)-3-methylpentanoic acid
Catalog ID
STL532645
SMILES CCC([C@@H](C(=O)O)NC(=O)[C@@H](NC(=O)[C@@H](n1c(O)nc2c(c1=O)cccc2)Cc1ccccc1)CC(=O)N)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 C27H31N5O7 MW 537.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H31N5O7/c1-3-15(2)22(26(37)38)31-23(34)19(14-21(28)33)29-24(35)20(13-16-9-5-4-6-10-16)32-25(36)17-11-7-8-12-18(17)30-27(32)39/h4-12,15,19-20,22H,3,13-14H2,1-2H3,(H2,28,33)(H,29,35)(H,30,39)(H,31,34)(H,37,38)/t15?,19-,20-,22-/m0/s1InChIKey
ZFMLCXCYJFDESP-OZVYSFRDSA-NSynonyms
957000-20-3(2~(S))2(((2~(S))4amino2(((2~(S))2(24dioxo1~(H)quinazolin3yl)3phenylpropanoyl)amino)4oxobutanoyl)amino)3methylpentanoicacid
(2S3R)2((S)4AMINO2((S)2(24DIOXO12DIHYDROQUINAZOLIN3(4H)YL)3PHENYLPROPANAMIDO)4OXOBUTANAMIDO)3METHYLPENTANOICACID
16404500
957000203
InChI=1SC27H31N5O7c1315(2)22(26(37)38)3123(34)19(1421(28)33)2924(35)20(131695461016)3225(36)1711781218(17)3027(32)39h41215192022H31314H212H3(H22833)(H2935)(H3039)(H3134)(H3738)t15?192022m0s1
ZINC000070700690
ZINC000070700691
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