Vitas-M small molecule compound
ethyl 4-[(N-{[(1S,5S)-8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocin-3(4H)-yl]carbonyl}-beta-alanyl)amino]benzoate
Catalog ID
STL563142
SMILES CCOC(=O)c1ccc(cc1)NC(=O)CCNC(=O)N1C[C@H]2C[C@@H](C1)c1n(C2)c(=O)ccc1
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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 C24H28N4O5 MW 452.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H28N4O5/c1-2-33-23(31)17-6-8-19(9-7-17)26-21(29)10-11-25-24(32)27-13-16-12-18(15-27)20-4-3-5-22(30)28(20)14-16/h3-9,16,18H,2,10-15H2,1H3,(H,25,32)(H,26,29)/t16-,18+/m0/s1InChIKey
HXSMEGJHMUCVEG-FUHWJXTLSA-NSynonyms
92508581
CCOC(=O)c1ccc(cc1)NC(=O)CCNC(=O)N1C(C@H)2C(C@@H)(C1)c1n(C2)c(=O)ccc1
ethyl4((N(((1S5S)8oxo1568tetrahydro2H15methanopyrido(12a)(15)diazocin3(4H)yl)carbonyl)betaalanyl)amino)benzoate
ethyl4(3(((1R9R)6oxo711diazatricyclo(731027)trideca24diene11carbonyl)amino)propanoylamino)benzoate
ethyl4(3((1R5R)8oxo234568hexahydro1H15methanopyrido(12a)(15)diazocine3carboxamido)propanamido)benzoate
InChI=1SC24H28N4O5c123323(31)176819(9717)2621(29)10112524(32)2713161218(1527)2043522(30)28(20)1416h391618H21015H21H3(H2532)(H2629)t1618+m0s1
MFCD32651404
ZINC000002093085
Check stock
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Check stock on Vitas-MAvailable files
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