Vitas-M small molecule compound
Catalog ID
STK572057
SMILES O=C(c1ccc(cc1)N1C(=O)[C@H]2N(C1=O)Cc1c(C2)cccc1)N[C@H](C(=O)O)C(O)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 C22H21N3O6 MW 423.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21N3O6/c1-12(26)18(21(29)30)23-19(27)13-6-8-16(9-7-13)25-20(28)17-10-14-4-2-3-5-15(14)11-24(17)22(25)31/h2-9,12,17-18,26H,10-11H2,1H3,(H,23,27)(H,29,30)/t12?,17-,18-/m0/s1InChIKey
AQQCHNKVQKIQAS-MIIWOSQWSA-NSynonyms
1014066-39-7(2S)2((4((10aS)13dioxo1010adihydro5Himidazo(15b)isoquinolin2yl)benzoyl)amino)3hydroxybutanoicacid
(2S3S)2(4((S)13dioxo1010adihydroimidazo(15b)isoquinolin2(1H3H5H)yl)benzamido)3hydroxybutanoicacid
1014066397
CC(C(C(=O)O)NC(=O)C1=CC=C(C=C1)N2C(=O)C3CC4=CC=CC=C4CN3C2=O)O
InChI=1SC22H21N3O6c112(26)18(21(29)30)2319(27)136816(9713)2520(28)171014423515(14)1124(17)22(25)31h2912171826H1011H21H3(H2327)(H2930)t12?1718m0s1
MFCD07640200
O=C(c1ccc(cc1)N1C(=O)(C@H)2N(C1=O)Cc1c(C2)cccc1)N(C@H)(C(=O)O)C(O)C
ZINC000009129459
ZINC000013591526
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.