Vitas-M small molecule compound
(2S,3S)-2-((R)-2-(2,4-dioxo-1,2-dihydroquinazolin-3(4H)-yl)-3-(1H-indol-3-yl)propanamido)-3-hydroxybutanoic acid
Catalog ID
STL530940
SMILES CC([C@@H](C(=O)O)NC(=O)[C@H](n1c(=O)[nH]c2c(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+/m1/s1InChIKey
HVOXVMJQPASPIQ-PUIOOCGESA-NSynonyms
956918-21-1(2~(S))2(((2~(R))2(24dioxo1~(H)quinazolin3yl)3(1~(H)indol3yl)propanoyl)amino)3hydroxybutanoicacid
(2S3S)2((R)2(24DIOXO12DIHYDROQUINAZOLIN3(4H)YL)3(1HINDOL3YL)PROPANAMIDO)3HYDROXYBUTANOICACID
16405839
956918211
CC((C@@H)(C(=O)O)NC(=O)(C@@H)(n1c(=O)(nH)c2c(c1=O)cccc2)Cc1c(nH)c2c1cccc2)O
InChI=1SC23H22N4O6c112(28)19(22(31)32)2620(29)18(1013112416842614(13)16)2721(30)15735917(15)2523(27)33h29111218192428H10H21H3(H2533)(H2629)(H3132)t12?1819+m1s1
MFCD07637249
ZINC000012888804
ZINC000012888810
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