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3-{3-[2-(2,3-dihydro-1-benzofuran-5-yl)ethoxy]-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
STL551013
SMILES COc1ccc(cc1OCCc1ccc2c(c1)CCO2)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 C37H39N3O8 MW 653.73 g/mol Purity >90% as per NMR
InChI
InChI=1S/C37H39N3O8/c1-45-32-8-6-24(15-33(32)47-11-9-22-5-7-31-25(13-22)10-12-46-31)28(17-34(38)42)37-36(44)30(41)16-27(48-37)21-39-18-23-14-26(20-39)29-3-2-4-35(43)40(29)19-23/h2-8,13,15-16,23,26,28,44H,9-12,14,17-21H2,1H3,(H2,38,42)/t23-,26+,28?/m1/s1
InChIKey
AMPLZJBGGIAEGH-JNBDQXKTSA-N
Synonyms

129895051
3(3(2(23dihydro1benzofuran5yl)ethoxy)4methoxyphenyl)3(3hydroxy4oxo6(((1~(S)9~(R))6oxo711diazatricyclo(7310^(27))trideca24dien11yl)methyl)pyran2yl)propanamide
3(3(2(23dihydro1benzofuran5yl)ethoxy)4methoxyphenyl)3(3hydroxy4oxo6(((1S5R)8oxo1568tetrahydro2H15methanopyrido(12a)(15)diazocin3(4H)yl)methyl)4Hpyran2yl)propanamide
3(3(2(23dihydrobenzofuran5yl)ethoxy)4methoxyphenyl)3(3hydroxy4oxo6(((1R5S)8oxo56dihydro1H15methanopyrido(12a)(15)diazocin3(2H4H8H)yl)methyl)4Hpyran2yl)propanamide
COc1ccc(cc1OCCc1ccc2c(c1)CCO2)C(c1oc(CN2C(C@H)3C(C@@H)(C2)c2n(C3)c(=O)ccc2)cc(=O)c1O)CC(=O)N
InChI=1SC37H39N3O8c145328624(1533(32)4711922573125(1322)10124631)28(1734(38)42)3736(44)30(41)1627(4837)213918231426(2039)2932435(43)40(29)1923h2813151623262844H912141721H21H3(H23842)t2326+28?m1s1
ZINC000524729620
ZINC000524729621

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Available files

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