Vitas-M small molecule compound
(2S,3S)-3-hydroxy-2-((S)-2-(2-hydroxy-4-oxoquinazolin-3(4H)-yl)-3-(1H-indol-3-yl)propanamido)butanoic acid
Catalog ID
STL533688
SMILES CC([C@@H](C(=O)O)NC(=O)[C@@H](n1c(O)nc2c(c1=O)cccc2)Cc1c[nH]c2c1cccc2)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 C23H22N4O6 MW 450.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H22N4O6/c1-12(28)19(22(31)32)26-20(29)18(10-13-11-24-16-8-4-2-6-14(13)16)27-21(30)15-7-3-5-9-17(15)25-23(27)33/h2-9,11-12,18-19,24,28H,10H2,1H3,(H,25,33)(H,26,29)(H,31,32)/t12?,18-,19-/m0/s1InChIKey
HVOXVMJQPASPIQ-MBXYGVAOSA-NSynonyms
956936-36-0(2~(S))2(((2~(S))2(24dioxo1~(H)quinazolin3yl)3(1~(H)indol3yl)propanoyl)amino)3hydroxybutanoicacid
(2S3S)2((S)2(24DIOXO12DIHYDROQUINAZOLIN3(4H)YL)3(1HINDOL3YL)PROPANAMIDO)3HYDROXYBUTANOICACID
16402912
956936360
InChI=1SC23H22N4O6c112(28)19(22(31)32)2620(29)18(1013112416842614(13)16)2721(30)15735917(15)2523(27)33h29111218192428H10H21H3(H2533)(H2629)(H3132)t12?1819m0s1
MFCD07203345
ZINC000002131876
ZINC000012878646
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