Vitas-M small molecule compound
tert-butyl {(2S)-1-oxo-1-[(1S,5R)-8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocin-3(4H)-yl]-3-phenylpropan-2-yl}carbamate
Catalog ID
STL540216
SMILES O=C(OC(C)(C)C)N[C@H](C(=O)N1C[C@H]2C[C@@H](C1)c1n(C2)c(=O)ccc1)Cc1ccccc1
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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 C25H31N3O4 MW 437.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H31N3O4/c1-25(2,3)32-24(31)26-20(13-17-8-5-4-6-9-17)23(30)27-14-18-12-19(16-27)21-10-7-11-22(29)28(21)15-18/h4-11,18-20H,12-16H2,1-3H3,(H,26,31)/t18-,19+,20-/m0/s1InChIKey
QEEFTXLJLJSBLO-ZCNNSNEGSA-NSynonyms
InChI=1SC25H31N3O4c125(23)3224(31)2620(13178546917)23(30)2714181219(1627)211071122(29)28(21)1518h4111820H1216H213H3(H2631)t1819+20m0s1
O=C(OC(C)(C)C)N(C@H)(C(=O)N1C(C@H)2C(C@@H)(C1)c1n(C2)c(=O)ccc1)Cc1ccccc1
tertbutyl((2S)1oxo1((1S5R)8oxo1568tetrahydro2H15methanopyrido(12a)(15)diazocin3(4H)yl)3phenylpropan2yl)carbamate
tertbutyl((S)1oxo1((1R5S)8oxo56dihydro1H15methanopyrido(12a)(15)diazocin3(2H4H8H)yl)3phenylpropan2yl)carbamate
ZINC000002115863
Check stock
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Check stock on Vitas-MAvailable files
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