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3-(4-hydroxy-3-methoxyphenyl)-3-(3-hydroxy-6-methyl-4-oxo-4H-pyran-2-yl)-N-{(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}propanamide

Catalog ID
STL550499
SMILES COc1cc(ccc1O)C(c1oc(C)cc(=O)c1O)CC(=O)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 C36H37N3O8 MW 639.71 g/mol Purity >90% as per NMR
InChI
InChI=1S/C36H37N3O8/c1-21-13-30(41)34(44)35(47-21)26(24-11-12-29(40)31(16-24)46-2)17-32(42)37-27(15-22-7-4-3-5-8-22)36(45)38-18-23-14-25(20-38)28-9-6-10-33(43)39(28)19-23/h3-13,16,23,25-27,40,44H,14-15,17-20H2,1-2H3,(H,37,42)/t23-,25+,26?,27+/m1/s1
InChIKey
ZHAOPDSWWPYEJT-ATKUJZGESA-N
Synonyms

127253770
3(4hydroxy3methoxyphenyl)3(3hydroxy6methyl4oxo4Hpyran2yl)N((2S)1oxo1((1S5R)8oxo1568tetrahydro2H15methanopyrido(12a)(15)diazocin3(4H)yl)3phenylpropan2yl)propanamide
3(4hydroxy3methoxyphenyl)3(3hydroxy6methyl4oxo4Hpyran2yl)N((S)1oxo1((1R5S)8oxo56dihydro1H15methanopyrido(12a)(15)diazocin3(2H4H8H)yl)3phenylpropan2yl)propanamide
3(4hydroxy3methoxyphenyl)3(3hydroxy6methyl4oxopyran2yl)~(N)((2~(S))1oxo1((1~(S)9~(R))6oxo711diazatricyclo(7310^(27))trideca24dien11yl)3phenylpropan2yl)propanamide
COc1cc(ccc1O)C(c1oc(C)cc(=O)c1O)CC(=O)N(C@H)(C(=O)N1C(C@H)2C(C@@H)(C1)c1n(C2)c(=O)ccc1)Cc1ccccc1
InChI=1SC36H37N3O8c1211330(41)34(44)35(4721)26(24111229(40)31(1624)462)1732(42)3727(15227435822)36(45)3818231425(2038)28961033(43)39(28)1923h313162325274044H14151720H212H3(H3742)t2325+26?27+m1s1
ZINC000604405330
ZINC000604405333

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Available files

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