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4-({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]-3-(3,4,5-trimethoxyphenyl)propanoyl}amino)-N-(pyridin-3-yl)butanamide

Catalog ID
STL552106
SMILES COc1cc(cc(c1OC)OC)C(c1c(O)cc2c(c1O)C(=O)O[C@@H](C)CCCC(=O)CCC/C=C/2)CC(=O)NCCCC(=O)Nc1cccnc1

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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 C39H47N3O10 MW 717.82 g/mol Purity >90% as per NMR
InChI
InChI=1S/C39H47N3O10/c1-24-11-8-15-28(43)14-7-5-6-12-25-19-30(44)36(37(47)35(25)39(48)52-24)29(26-20-31(49-2)38(51-4)32(21-26)50-3)22-34(46)41-18-10-16-33(45)42-27-13-9-17-40-23-27/h6,9,12-13,17,19-21,23-24,29,44,47H,5,7-8,10-11,14-16,18,22H2,1-4H3,(H,41,
InChIKey
NZZVAMHPGZVXEQ-PYBASFRDSA-N
Synonyms

135640400
4((3((3S11E)1416dihydroxy3methyl17dioxo345678910octahydro1H2benzoxacyclotetradecin15yl)3(345trimethoxyphenyl)propanoyl)amino)N(pyridin3yl)butanamide
4((3((4~(S)12~(E))1618dihydroxy4methyl28dioxo3oxabicyclo(1240)octadeca1(18)121416tetraen17yl)3(345trimethoxyphenyl)propanoyl)amino)~(N)pyridin3ylbutanamide
4(3((SE)1416dihydroxy3methyl17dioxo345678910octahydro1Hbenzo(c)(1)oxacyclotetradecin15yl)3(345trimethoxyphenyl)propanamido)N(pyridin3yl)butanamide
COc1cc(cc(c1OC)OC)C(c1c(O)cc2c(c1O)C(=O)O(C@@H)(C)CCCC(=O)CCCC=C2)CC(=O)NCCCC(=O)Nc1cccnc1
InChI=1SC39H47N3O10c1241181528(43)1475612251930(44)36(37(47)35(25)39(48)5224)29(262031(492)38(514)32(2126)503)2234(46)4118101633(45)422713917402327h6912131719212324294447H578101114161822H214H3(H4146)(H4245)b126+t2429?m0s1
ZINC001547139347
ZINC001547139348

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Available files

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