Vitas-M small molecule compound
N-[(2S)-2-(2-hydroxy-4-oxoquinazolin-3(4H)-yl)-3-(1H-indol-3-yl)propanoyl]-L-valyl-L-alanine
Catalog ID
STL531518
SMILES CC([C@@H](C(=O)N[C@H](C(=O)O)C)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 C27H29N5O6 MW 519.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H29N5O6/c1-14(2)22(24(34)29-15(3)26(36)37)31-23(33)21(12-16-13-28-19-10-6-4-8-17(16)19)32-25(35)18-9-5-7-11-20(18)30-27(32)38/h4-11,13-15,21-22,28H,12H2,1-3H3,(H,29,34)(H,30,38)(H,31,33)(H,36,37)/t15-,21-,22-/m0/s1InChIKey
LKTUJUDNQJTEHZ-RXYZOABWSA-NSynonyms
957000-02-1(2~(S))2(((2~(S))2(((2~(S))2(24dioxo1~(H)quinazolin3yl)3(1~(H)indol3yl)propanoyl)amino)3methylbutanoyl)amino)propanoicacid
(S)2((S)2((S)2(24DIOXO12DIHYDROQUINAZOLIN3(4H)YL)3(1HINDOL3YL)PROPANAMIDO)3METHYLBUTANAMIDO)PROPANOICACID
16404445
957000021
InChI=1SC27H29N5O6c114(2)22(24(34)2915(3)26(36)37)3123(33)21(12161328191064817(16)19)3225(35)189571120(18)3027(32)38h4111315212228H12H213H3(H2934)(H3038)(H3133)(H3637)t152122m0s1
N((2S)2(2hydroxy4oxoquinazolin3(4H)yl)3(1Hindol3yl)propanoyl)LvalylLalanine
ZINC000015968150
ZINC15968150
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