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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-{3-oxo-3-[2-(pyridin-3-yl)piperidin-1-yl]propyl}-3-(3,4,5-trimethoxyphenyl)propanamide

Catalog ID
STL551634
SMILES COc1cc(cc(c1OC)OC)C(c1c(O)cc2c(c1O)C(=O)O[C@@H](C)CCCC(=O)CCC/C=C/2)CC(=O)NCCC(=O)N1CCCCC1c1cccnc1

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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 C43H53N3O10 MW 771.91 g/mol Purity >90% as per NMR
InChI
InChI=1S/C43H53N3O10/c1-27-12-10-16-31(47)15-7-5-6-13-28-22-34(48)40(41(51)39(28)43(52)56-27)32(30-23-35(53-2)42(55-4)36(24-30)54-3)25-37(49)45-20-18-38(50)46-21-9-8-17-33(46)29-14-11-19-44-26-29/h6,11,13-14,19,22-24,26-27,32-33,48,51H,5,7-10,12,15-18,20-
InChIKey
FMXFOKKYTVYAAQ-CHTVSWLSSA-N
Synonyms

135639998
3((3S11E)1416dihydroxy3methyl17dioxo345678910octahydro1H2benzoxacyclotetradecin15yl)N(3oxo3(2(pyridin3yl)piperidin1yl)propyl)3(345trimethoxyphenyl)propanamide
3((4~(S)12~(E))1618dihydroxy4methyl28dioxo3oxabicyclo(1240)octadeca1(18)121416tetraen17yl)~(N)(3oxo3(2pyridin3ylpiperidin1yl)propyl)3(345trimethoxyphenyl)propanamide
3((SE)1416dihydroxy3methyl17dioxo345678910octahydro1Hbenzo(c)(1)oxacyclotetradecin15yl)N(3oxo3(2(pyridin3yl)piperidin1yl)propyl)3(345trimethoxyphenyl)propanamide
COc1cc(cc(c1OC)OC)C(c1c(O)cc2c(c1O)C(=O)O(C@@H)(C)CCCC(=O)CCCC=C2)CC(=O)NCCC(=O)N1CCCCC1c1cccnc1
InChI=1SC43H53N3O10c12712101631(47)1575613282234(48)40(41(51)39(28)43(52)5627)32(302335(532)42(554)36(2430)543)2537(49)45201838(50)4621981733(46)29141119442629h6111314192224262732334851H5710121518202125H214H3(H4549)b136+t2732?33?m0s1
ZINC001547139087
ZINC001547139092

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Available files

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