Vitas-M small molecule compound
(2S,3R)-2-((S)-2-(2-hydroxy-4-oxoquinazolin-3(4H)-yl)-3-(1H-indol-3-yl)propanamido)-3-methylpentanoic acid
Catalog ID
STL533031
SMILES CCC([C@@H](C(=O)O)NC(=O)[C@@H](n1c(O)nc2c(c1=O)cccc2)Cc1c[nH]c2c1cccc2)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 C25H26N4O5 MW 462.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H26N4O5/c1-3-14(2)21(24(32)33)28-22(30)20(12-15-13-26-18-10-6-4-8-16(15)18)29-23(31)17-9-5-7-11-19(17)27-25(29)34/h4-11,13-14,20-21,26H,3,12H2,1-2H3,(H,27,34)(H,28,30)(H,32,33)/t14?,20-,21-/m0/s1InChIKey
WQEIPNVUCRYBFD-CWKJCNCHSA-NSynonyms
957030-34-1(2~(S))2(((2~(S))2(24dioxo1~(H)quinazolin3yl)3(1~(H)indol3yl)propanoyl)amino)3methylpentanoicacid
(2S3R)2((S)2(24DIOXO12DIHYDROQUINAZOLIN3(4H)YL)3(1HINDOL3YL)PROPANAMIDO)3METHYLPENTANOICACID
16402848
957030341
InChI=1SC25H26N4O5c1314(2)21(24(32)33)2822(30)20(12151326181064816(15)18)2923(31)179571119(17)2725(29)34h4111314202126H312H212H3(H2734)(H2830)(H3233)t14?2021m0s1
ZINC000009330726
ZINC000012878351
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