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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-[(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydropyrimidin-4-yl)methyl]-3-(3,4,5-trimethoxyphenyl)propanamide

Catalog ID
STL551752
SMILES COc1cc(cc(c1OC)OC)C(c1c(O)cc2c(c1O)C(=O)O[C@@H](C)CCCC(=O)CCC/C=C/2)CC(=O)NCc1cc(=O)n(c(=O)n1C)C

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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 C37H45N3O11 MW 707.78 g/mol Purity >90% as per NMR
InChI
InChI=1S/C37H45N3O11/c1-21-11-10-14-25(41)13-9-7-8-12-22-15-27(42)33(34(45)32(22)36(46)51-21)26(23-16-28(48-4)35(50-6)29(17-23)49-5)19-30(43)38-20-24-18-31(44)40(3)37(47)39(24)2/h8,12,15-18,21,26,42,45H,7,9-11,13-14,19-20H2,1-6H3,(H,38,43)/b12-8+/t21-,26?
InChIKey
SCLACSVARYFBNG-UBXLDYOZSA-N
Synonyms

135640104
3((3S11E)1416dihydroxy3methyl17dioxo345678910octahydro1H2benzoxacyclotetradecin15yl)N((13dimethyl26dioxo1236tetrahydropyrimidin4yl)methyl)3(345trimethoxyphenyl)propanamide
3((4~(S)12~(E))1618dihydroxy4methyl28dioxo3oxabicyclo(1240)octadeca1(18)121416tetraen17yl)~(N)((13dimethyl26dioxopyrimidin4yl)methyl)3(345trimethoxyphenyl)propanamide
3((SE)1416dihydroxy3methyl17dioxo345678910octahydro1Hbenzo(c)(1)oxacyclotetradecin15yl)N((13dimethyl26dioxo1236tetrahydropyrimidin4yl)methyl)3(345trimethoxyphenyl)propanamide
COc1cc(cc(c1OC)OC)C(c1c(O)cc2c(c1O)C(=O)O(C@@H)(C)CCCC(=O)CCCC=C2)CC(=O)NCc1cc(=O)n(c(=O)n1C)C
InChI=1SC37H45N3O11c12111101425(41)1397812221527(42)33(34(45)32(22)36(46)5121)26(231628(484)35(506)29(1723)495)1930(43)3820241831(44)40(3)37(47)39(24)2h812151821264245H791113141920H216H3(H3843)b128+t2126?m0s1
ZINC001547138801
ZINC001547138802

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Available files

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