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3-[(3S,11E)-14,16-dihydroxy-3-methyl-1,7-dioxo-3,4,5,6,7,8,9,10-octahydro-1H-2-benzoxacyclotetradecin-15-yl]-N-[2-oxo-2-(pyridin-2-ylamino)ethyl]-3-(3,4,5-trimethoxyphenyl)propanamide

Catalog ID
STL552166
SMILES COc1cc(cc(c1OC)OC)C(c1c(O)cc2c(c1O)C(=O)O[C@@H](C)CCCC(=O)CCC/C=C/2)CC(=O)NCC(=O)Nc1ccccn1

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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 C37H43N3O10 MW 689.76 g/mol Purity >90% as per NMR
InChI
InChI=1S/C37H43N3O10/c1-22-11-10-14-25(41)13-7-5-6-12-23-17-27(42)34(35(45)33(23)37(46)50-22)26(24-18-28(47-2)36(49-4)29(19-24)48-3)20-31(43)39-21-32(44)40-30-15-8-9-16-38-30/h6,8-9,12,15-19,22,26,42,45H,5,7,10-11,13-14,20-21H2,1-4H3,(H,39,43)(H,38,40,44)
InChIKey
QXTYAUODZVDLOM-FHZLZYJPSA-N
Synonyms

135640446
3((3S11E)1416dihydroxy3methyl17dioxo345678910octahydro1H2benzoxacyclotetradecin15yl)N(2oxo2(pyridin2ylamino)ethyl)3(345trimethoxyphenyl)propanamide
3((4~(S)12~(E))1618dihydroxy4methyl28dioxo3oxabicyclo(1240)octadeca1(18)121416tetraen17yl)~(N)(2oxo2(pyridin2ylamino)ethyl)3(345trimethoxyphenyl)propanamide
3((SE)1416dihydroxy3methyl17dioxo345678910octahydro1Hbenzo(c)(1)oxacyclotetradecin15yl)N(2oxo2(pyridin2ylamino)ethyl)3(345trimethoxyphenyl)propanamide
COc1cc(cc(c1OC)OC)C(c1c(O)cc2c(c1O)C(=O)O(C@@H)(C)CCCC(=O)CCCC=C2)CC(=O)NCC(=O)Nc1ccccn1
InChI=1SC37H43N3O10c12211101425(41)1375612231727(42)34(35(45)33(23)37(46)5022)26(241828(472)36(494)29(1924)483)2031(43)392132(44)40301589163830h68912151922264245H57101113142021H214H3(H3943)(H384044)b126+t2226?m0s1
ZINC001547138733
ZINC001547138736

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Available files

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