Vitas-M small molecule compound
2-(3-hydroxy-6-methyl-4-oxo-2',3',5',6'-tetrahydro-4H,4'H-2,4'-bipyran-4'-yl)-N-{3-oxo-3-[(1S,5R)-8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocin-3(4H)-yl]propyl}acetamide
Catalog ID
STL551669
SMILES O=C(CC1(CCOCC1)c1oc(C)cc(=O)c1O)NCCC(=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 C27H33N3O7 MW 511.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H33N3O7/c1-17-11-21(31)25(35)26(37-17)27(6-9-36-10-7-27)13-22(32)28-8-5-23(33)29-14-18-12-19(16-29)20-3-2-4-24(34)30(20)15-18/h2-4,11,18-19,35H,5-10,12-16H2,1H3,(H,28,32)/t18-,19+/m1/s1InChIKey
YIBYUMDLSWQFBQ-MOPGFXCFSA-NSynonyms
135640030
2(3hydroxy6methyl4oxo2356tetrahydro4H4H24bipyran4yl)N(3oxo3((1S5R)8oxo1568tetrahydro2H15methanopyrido(12a)(15)diazocin3(4H)yl)propyl)acetamide
2(4(3hydroxy6methyl4oxo4Hpyran2yl)tetrahydro2Hpyran4yl)N(3oxo3((1R5S)8oxo56dihydro1H15methanopyrido(12a)(15)diazocin3(2H4H8H)yl)propyl)acetamide
2(4(3hydroxy6methyl4oxopyran2yl)oxan4yl)~(N)(3oxo3((1~(S)9~(R))6oxo711diazatricyclo(7310^(27))trideca24dien11yl)propyl)acetamide
InChI=1SC27H33N3O7c1171121(31)25(35)26(3717)27(693610727)1322(32)288523(33)2914181219(1629)2032424(34)30(20)1518h2411181935H5101216H21H3(H2832)t1819+m1s1
O=C(CC1(CCOCC1)c1oc(C)cc(=O)c1O)NCCC(=O)N1C(C@H)2C(C@@H)(C1)c1n(C2)c(=O)ccc1
ZINC001547139001
Check stock
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Check stock on Vitas-MAvailable files
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