Vitas-M small molecule compound
N-{3-[(10aS)-1,3-dioxo-1,5,10,10a-tetrahydroimidazo[1,5-b]isoquinolin-2(3H)-yl]propanoyl}-L-phenylalanine
Catalog ID
STL529892
SMILES O=C(N[C@H](C(=O)O)Cc1ccccc1)CCN1C(=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 C23H23N3O5 MW 421.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H23N3O5/c27-20(24-18(22(29)30)12-15-6-2-1-3-7-15)10-11-25-21(28)19-13-16-8-4-5-9-17(16)14-26(19)23(25)31/h1-9,18-19H,10-14H2,(H,24,27)(H,29,30)/t18-,19-/m0/s1InChIKey
FMSWDQKKHNMTCT-OALUTQOASA-NSynonyms
1173678-95-9(2~(S))2(3((10~(a)~(S))13dioxo1010~(a)dihydro5~(H)imidazo(15b)isoquinolin2yl)propanoylamino)3phenylpropanoicacid
(R)2(3((S)13dioxo1010adihydroimidazo(15b)isoquinolin2(1H3H5H)yl)propanamido)3phenylpropanoicacid
1173678959
16405646
InChI=1SC23H23N3O5c2720(2418(22(29)30)12156213715)10112521(28)191316845917(16)1426(19)23(25)31h191819H1014H2(H2427)(H2930)t1819m0s1
N(3((10aS)13dioxo151010atetrahydroimidazo(15b)isoquinolin2(3H)yl)propanoyl)Lphenylalanine
O=C(N(C@@H)(C(=O)O)Cc1ccccc1)CCN1C(=O)(C@H)2N(C1=O)Cc1c(C2)cccc1
ZINC000008791828
ZINC8791828
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