Vitas-M small molecule compound
N-[(2S)-2-(2-hydroxy-4-oxoquinazolin-3(4H)-yl)-3-phenylpropanoyl]-L-phenylalanyl-L-valine
Catalog ID
STL529767
SMILES O=C([C@@H](NC(=O)[C@@H](n1c(O)nc2c(c1=O)cccc2)Cc1ccccc1)Cc1ccccc1)N[C@H](C(=O)O)C(C)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 C31H32N4O6 MW 556.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H32N4O6/c1-19(2)26(30(39)40)34-27(36)24(17-20-11-5-3-6-12-20)32-28(37)25(18-21-13-7-4-8-14-21)35-29(38)22-15-9-10-16-23(22)33-31(35)41/h3-16,19,24-26H,17-18H2,1-2H3,(H,32,37)(H,33,41)(H,34,36)(H,39,40)/t24-,25-,26-/m0/s1InChIKey
QXJHKOPEADJZIO-GSDHBNRESA-NSynonyms
956965-27-8(2~(S))2(((2~(S))2(((2~(S))2(24dioxo1~(H)quinazolin3yl)3phenylpropanoyl)amino)3phenylpropanoyl)amino)3methylbutanoicacid
(S)2((S)2((S)2(24DIOXO12DIHYDROQUINAZOLIN3(4H)YL)3PHENYLPROPANAMIDO)3PHENYLPROPANAMIDO)3METHYLBUTANOICACID
16405883
956965278
InChI=1SC31H32N4O6c119(2)26(30(39)40)3427(36)24(1720115361220)3228(37)25(1821137481421)3529(38)22159101623(22)3331(35)41h316192426H1718H212H3(H3237)(H3341)(H3436)(H3940)t242526m0s1
N((2S)2(2hydroxy4oxoquinazolin3(4H)yl)3phenylpropanoyl)LphenylalanylLvaline
ZINC000070706121
ZINC70706121
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