Vitas-M small molecule compound
(S)-2-((2S,3R)-2-((S)-2-(2-hydroxy-4-oxoquinazolin-3(4H)-yl)-3-phenylpropanamido)-3-methylpentanamido)-3-methylbutanoic acid
Catalog ID
STL530334
SMILES CCC([C@@H](C(=O)N[C@H](C(=O)O)C(C)C)NC(=O)[C@@H](n1c(O)nc2c(c1=O)cccc2)Cc1ccccc1)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 C28H34N4O6 MW 522.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H34N4O6/c1-5-17(4)23(25(34)30-22(16(2)3)27(36)37)31-24(33)21(15-18-11-7-6-8-12-18)32-26(35)19-13-9-10-14-20(19)29-28(32)38/h6-14,16-17,21-23H,5,15H2,1-4H3,(H,29,38)(H,30,34)(H,31,33)(H,36,37)/t17?,21-,22-,23-/m0/s1InChIKey
TUYUARLXNQWHBX-PRKPZBFWSA-NSynonyms
956818-47-6(2~(S))2(((2~(S))2(((2~(S))2(24dioxo1~(H)quinazolin3yl)3phenylpropanoyl)amino)3methylpentanoyl)amino)3methylbutanoicacid
(S)2((2S3R)2((S)2(24DIOXO12DIHYDROQUINAZOLIN3(4H)YL)3PHENYLPROPANAMIDO)3METHYLPENTANAMIDO)3METHYLBUTANOICACID
16403930
956818476
InChI=1SC28H34N4O6c1517(4)23(25(34)3022(16(2)3)27(36)37)3124(33)21(1518117681218)3226(35)19139101420(19)2928(32)38h61416172123H515H214H3(H2938)(H3034)(H3133)(H3637)t17?212223m0s1
ZINC000070699670
ZINC000070699672
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