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3-{2-[2-(2,3-dihydro-1-benzofuran-5-yl)ethoxy]phenyl}-3-(3-hydroxy-4-oxo-6-{[(1S,5R)-8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocin-3(4H)-yl]methyl}-4H-pyran-2-yl)propanamide

Catalog ID
STL549892
SMILES NC(=O)CC(c1ccccc1OCCc1ccc2c(c1)CCO2)c1oc(CN2C[C@H]3C[C@@H](C2)c2n(C3)c(=O)ccc2)cc(=O)c1O

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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 C36H37N3O7 MW 623.71 g/mol Purity >90% as per NMR
InChI
InChI=1S/C36H37N3O7/c37-33(41)17-28(27-4-1-2-6-32(27)45-12-10-22-8-9-31-24(14-22)11-13-44-31)36-35(43)30(40)16-26(46-36)21-38-18-23-15-25(20-38)29-5-3-7-34(42)39(29)19-23/h1-9,14,16,23,25,28,43H,10-13,15,17-21H2,(H2,37,41)/t23-,25+,28?/m1/s1
InChIKey
URPPHEWURHCWMY-WBUDJUEKSA-N
Synonyms

132285868
3(2(2(23dihydro1benzofuran5yl)ethoxy)phenyl)3(3hydroxy4oxo6(((1~(S)9~(R))6oxo711diazatricyclo(7310^(27))trideca24dien11yl)methyl)pyran2yl)propanamide
3(2(2(23dihydro1benzofuran5yl)ethoxy)phenyl)3(3hydroxy4oxo6(((1S5R)8oxo1568tetrahydro2H15methanopyrido(12a)(15)diazocin3(4H)yl)methyl)4Hpyran2yl)propanamide
3(2(2(23dihydrobenzofuran5yl)ethoxy)phenyl)3(3hydroxy4oxo6(((1R5S)8oxo56dihydro1H15methanopyrido(12a)(15)diazocin3(2H4H8H)yl)methyl)4Hpyran2yl)propanamide
InChI=1SC36H37N3O7c3733(41)1728(27412632(27)45121022893124(1422)11134431)3635(43)30(40)1626(4636)213818231525(2038)2953734(42)39(29)1923h19141623252843H1013151721H2(H23741)t2325+28?m1s1
NC(=O)CC(c1ccccc1OCCc1ccc2c(c1)CCO2)c1oc(CN2C(C@@H)3C(C@@H)(C2)c2n(C3)c(=O)ccc2)cc(=O)c1O
ZINC000888088856
ZINC000888088857

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Available files

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