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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-hydroxy-3-(4-methoxyphenoxy)propyl]-3-(3,4,5-trimethoxyphenyl)propanamide

Catalog ID
STL551758
SMILES COc1ccc(cc1)OCC(CNC(=O)CC(c1c(O)cc2c(c1O)C(=O)O[C@@H](C)CCCC(=O)CCC/C=C/2)c1cc(OC)c(c(c1)OC)OC)O

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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 C40H49NO12 MW 735.83 g/mol Purity >90% as per NMR
InChI
InChI=1S/C40H49NO12/c1-24-10-9-13-27(42)12-8-6-7-11-25-18-32(44)37(38(46)36(25)40(47)53-24)31(26-19-33(49-3)39(51-5)34(20-26)50-4)21-35(45)41-22-28(43)23-52-30-16-14-29(48-2)15-17-30/h7,11,14-20,24,28,31,43-44,46H,6,8-10,12-13,21-23H2,1-5H3,(H,41,45)/b11-
InChIKey
REUUOXCMDVXUIY-MORTYYIUSA-N
Synonyms

135640110
3((3S11E)1416dihydroxy3methyl17dioxo345678910octahydro1H2benzoxacyclotetradecin15yl)N(2hydroxy3(4methoxyphenoxy)propyl)3(345trimethoxyphenyl)propanamide
3((4~(S)12~(E))1618dihydroxy4methyl28dioxo3oxabicyclo(1240)octadeca1(18)121416tetraen17yl)~(N)(2hydroxy3(4methoxyphenoxy)propyl)3(345trimethoxyphenyl)propanamide
3((SE)1416dihydroxy3methyl17dioxo345678910octahydro1Hbenzo(c)(1)oxacyclotetradecin15yl)N(2hydroxy3(4methoxyphenoxy)propyl)3(345trimethoxyphenyl)propanamide
COc1ccc(cc1)OCC(CNC(=O)CC(c1c(O)cc2c(c1O)C(=O)O(C@@H)(C)CCCC(=O)CCCC=C2)c1cc(OC)c(c(c1)OC)OC)O
InChI=1SC40H49NO12c1241091327(42)1286711251832(44)37(38(46)36(25)40(47)5324)31(261933(493)39(515)34(2026)504)2135(45)412228(43)235230161429(482)151730h7111420242831434446H681012132123H215H3(H4145)b117+t2428?31?m0s1
ZINC001547139491
ZINC001547139494

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Available files

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