Vitas-M small molecule compound
(2R,3R)-2-(6-((S)-1,3-dioxo-10,10a-dihydroimidazo[1,5-b]isoquinolin-2(1H,3H,5H)-yl)hexanamido)-3-hydroxybutanoic acid
Catalog ID
STL565510
SMILES O=C(N[C@@H](C(=O)O)C(O)C)CCCCCN1C(=O)[C@H]2N(C1=O)Cc1c(C2)cccc1
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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 C21H27N3O6 MW 417.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H27N3O6/c1-13(25)18(20(28)29)22-17(26)9-3-2-6-10-23-19(27)16-11-14-7-4-5-8-15(14)12-24(16)21(23)30/h4-5,7-8,13,16,18,25H,2-3,6,9-12H2,1H3,(H,22,26)(H,28,29)/t13?,16-,18+/m0/s1InChIKey
SIZFOSKVBBHSCF-VQGXLBNPSA-NSynonyms
957024-59-8(2R)2(6((10aS)13dioxo1010adihydro5Himidazo(15b)isoquinolin2yl)hexanoylamino)3hydroxybutanoicacid
(2R3R)2(6((S)13dioxo1010adihydroimidazo(15b)isoquinolin2(1H3H5H)yl)hexanamido)3hydroxybutanoicacid
16405532
957024598
InChI=1SC21H27N3O6c113(25)18(20(28)29)2217(26)9326102319(27)161114745815(14)1224(16)21(23)30h457813161825H236912H21H3(H2226)(H2829)t13?1618+m0s1
MFCD07637030
O=C(N(C@@H)(C(=O)O)C(O)C)CCCCCN1C(=O)(C@H)2N(C1=O)Cc1c(C2)cccc1
ZINC000004090201
ZINC000012888345
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