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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-(methoxymethyl)-1H-1,2,4-triazol-5-yl](4-methoxyphenyl)methyl}-3-(3,4,5-trimethoxyphenyl)propanamide

Catalog ID
STL551825
SMILES COCc1n[nH]c(n1)C(c1ccc(cc1)OC)NC(=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

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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 C42H50N4O11 MW 786.88 g/mol Purity >90% as per NMR
InChI
InChI=1S/C42H50N4O11/c1-24-11-10-14-28(47)13-9-7-8-12-26-19-31(48)37(39(50)36(26)42(51)57-24)30(27-20-32(54-4)40(56-6)33(21-27)55-5)22-35(49)44-38(25-15-17-29(53-3)18-16-25)41-43-34(23-52-2)45-46-41/h8,12,15-21,24,30,38,48,50H,7,9-11,13-14,22-23H2,1-6H3,(
InChIKey
SRAIVVCOXBAGKZ-KYHNRMATSA-N
Synonyms

135640164
3((3S11E)1416dihydroxy3methyl17dioxo345678910octahydro1H2benzoxacyclotetradecin15yl)N((3(methoxymethyl)1H124triazol5yl)(4methoxyphenyl)methyl)3(345trimethoxyphenyl)propanamide
3((4~(S)12~(E))1618dihydroxy4methyl28dioxo3oxabicyclo(1240)octadeca1(18)121416tetraen17yl)~(N)((5(methoxymethyl)1~(H)124triazol3yl)(4methoxyphenyl)methyl)3(345trimethoxyphenyl)propanamide
3((SE)1416dihydroxy3methyl17dioxo345678910octahydro1Hbenzo(c)(1)oxacyclotetradecin15yl)N((5(methoxymethyl)1H124triazol3yl)(4methoxyphenyl)methyl)3(345trimethoxyphenyl)propanamide
COCc1(nH)nc(n1)C(c1ccc(cc1)OC)NC(=O)CC(c1c(O)cc2c(c1O)C(=O)O(C@@H)(C)CCCC(=O)CCCC=C2)c1cc(OC)c(c(c1)OC)OC
InChI=1SC42H50N4O11c12411101428(47)1397812261931(48)37(39(50)36(26)42(51)5724)30(272032(544)40(566)33(2127)555)2235(49)4438(25151729(533)181625)414334(23522)454641h81215212430384850H791113142223H216H3(H4449)(H434546)b128+t2430?38?m0s1
ZINC001547139265
ZINC001547139268

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Available files

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