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3-(3-{[4-(acetylamino)phenoxy]methyl}-4-methoxyphenyl)-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
STL551519
SMILES COc1ccc(cc1COc1ccc(cc1)NC(=O)C)C(c1oc(CN2C[C@H]3C[C@@H](C2)c2n(C3)c(=O)ccc2)cc(=O)c1O)CC(=O)N

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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 C36H38N4O8 MW 654.72 g/mol Purity >90% as per NMR
InChI
InChI=1S/C36H38N4O8/c1-21(41)38-26-7-9-27(10-8-26)47-20-25-13-23(6-11-32(25)46-2)29(15-33(37)43)36-35(45)31(42)14-28(48-36)19-39-16-22-12-24(18-39)30-4-3-5-34(44)40(30)17-22/h3-11,13-14,22,24,29,45H,12,15-20H2,1-2H3,(H2,37,43)(H,38,41)/t22-,24+,29?/m1/s1
InChIKey
FFYLTHWDGRLFPC-ZDFIXTKISA-N
Synonyms

129895067
3(3((4(acetylamino)phenoxy)methyl)4methoxyphenyl)3(3hydroxy4oxo6(((1S5R)8oxo1568tetrahydro2H15methanopyrido(12a)(15)diazocin3(4H)yl)methyl)4Hpyran2yl)propanamide
3(3((4acetamidophenoxy)methyl)4methoxyphenyl)3(3hydroxy4oxo6(((1~(S)9~(R))6oxo711diazatricyclo(7310^(27))trideca24dien11yl)methyl)pyran2yl)propanamide
3(3((4acetamidophenoxy)methyl)4methoxyphenyl)3(3hydroxy4oxo6(((1R5S)8oxo56dihydro1H15methanopyrido(12a)(15)diazocin3(2H4H8H)yl)methyl)4Hpyran2yl)propanamide
COc1ccc(cc1COc1ccc(cc1)NC(=O)C)C(c1oc(CN2C(C@H)3C(C@@H)(C2)c2n(C3)c(=O)ccc2)cc(=O)c1O)CC(=O)N
InChI=1SC36H38N4O8c121(41)38267927(10826)4720251323(61132(25)462)29(1533(37)43)3635(45)31(42)1428(4836)193916221224(1839)3043534(44)40(30)1722h311131422242945H121520H212H3(H23743)(H3841)t2224+29?m1s1
ZINC000524729693
ZINC000524729694

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Available files

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