Vitas-M small molecule compound
N-{[(1S)-8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocin-3(4H)-yl]carbonyl}-D-valine
Catalog ID
STK801608
SMILES O=C(N1C[C@H]2C[C@@H](C1)c1n(C2)c(=O)ccc1)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 C17H23N3O4 MW 333.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H23N3O4/c1-10(2)15(16(22)23)18-17(24)19-7-11-6-12(9-19)13-4-3-5-14(21)20(13)8-11/h3-5,10-12,15H,6-9H2,1-2H3,(H,18,24)(H,22,23)/t11-,12+,15+/m0/s1InChIKey
KNTVOOKRMLJSKO-YWPYICTPSA-NSynonyms
(S)3methyl2((1R5R)8oxo234568hexahydro1H15methanopyrido(12a)(15)diazocine3carboxamido)butanoicacid
CC(C)C(C(=O)O)NC(=O)N1CC2CC(C1)C3=CC=CC(=O)N3C2
InChI=1SC17H23N3O4c110(2)15(16(22)23)1817(24)19711612(919)1343514(21)20(13)811h35101215H69H212H3(H1824)(H2223)t1112+15m1s1
MFCD13372539
N(((1S)8oxo1568tetrahydro2H15methanopyrido(12a)(15)diazocin3(4H)yl)carbonyl)Dvaline
O=C(N1C(C@H)2C(C@@H)(C1)c1n(C2)c(=O)ccc1)N(C@@H)(C(=O)O)C(C)C
O=C(N1C(C@H)2C(C@@H)(C1)c1n(C2)c(=O)ccc1)N(C@H)(C(=O)O)C(C)C
ZINC000101123240
ZINC6256776
Check stock
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Check stock on Vitas-MAvailable files
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