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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-2-(4-hydroxyphenyl)ethyl]-3-(3,4,5-trimethoxyphenyl)propanamide

Catalog ID
STL552533
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(c1ccc(cc1)O)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 C38H45NO11 MW 691.78 g/mol Purity >90% as per NMR
InChI
InChI=1S/C38H45NO11/c1-22-9-8-12-26(40)11-7-5-6-10-24-17-29(42)35(36(45)34(24)38(46)50-22)28(25-18-31(47-2)37(49-4)32(19-25)48-3)20-33(44)39-21-30(43)23-13-15-27(41)16-14-23/h6,10,13-19,22,28,30,41-43,45H,5,7-9,11-12,20-21H2,1-4H3,(H,39,44)/b10-6+/t22-,28
InChIKey
PBLYCOBZKZJDLH-FRNBXYIASA-N
Synonyms

135640753
3((3S11E)1416dihydroxy3methyl17dioxo345678910octahydro1H2benzoxacyclotetradecin15yl)N(2hydroxy2(4hydroxyphenyl)ethyl)3(345trimethoxyphenyl)propanamide
3((4~(S)12~(E))1618dihydroxy4methyl28dioxo3oxabicyclo(1240)octadeca1(18)121416tetraen17yl)~(N)(2hydroxy2(4hydroxyphenyl)ethyl)3(345trimethoxyphenyl)propanamide
3((SE)1416dihydroxy3methyl17dioxo345678910octahydro1Hbenzo(c)(1)oxacyclotetradecin15yl)N(2hydroxy2(4hydroxyphenyl)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(c1ccc(cc1)O)O
InChI=1SC38H45NO11c122981226(40)1175610241729(42)35(36(45)34(24)38(46)5022)28(251831(472)37(494)32(1925)483)2033(44)392130(43)23131527(41)161423h6101319222830414345H57911122021H214H3(H3944)b106+t2228?30?m0s1
ZINC001547139388
ZINC001547139391

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Available files

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