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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-(2-oxopyrrolidin-1-yl)ethyl]-3-(3,4,5-trimethoxyphenyl)propanamide

Catalog ID
STL552223
SMILES COc1cc(cc(c1OC)OC)C(c1c(O)cc2c(c1O)C(=O)O[C@@H](C)CCCC(=O)CCC/C=C/2)CC(=O)NCCN1CCCC1=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 C36H46N2O10 MW 666.77 g/mol Purity >90% as per NMR
InChI
InChI=1S/C36H46N2O10/c1-22-10-8-13-25(39)12-7-5-6-11-23-18-27(40)33(34(43)32(23)36(44)48-22)26(21-30(41)37-15-17-38-16-9-14-31(38)42)24-19-28(45-2)35(47-4)29(20-24)46-3/h6,11,18-20,22,26,40,43H,5,7-10,12-17,21H2,1-4H3,(H,37,41)/b11-6+/t22-,26?/m0/s1
InChIKey
DDPZSICSEYRECQ-FICULBEYSA-N
Synonyms

135640495
3((3S11E)1416dihydroxy3methyl17dioxo345678910octahydro1H2benzoxacyclotetradecin15yl)N(2(2oxopyrrolidin1yl)ethyl)3(345trimethoxyphenyl)propanamide
3((4~(S)12~(E))1618dihydroxy4methyl28dioxo3oxabicyclo(1240)octadeca1(18)121416tetraen17yl)~(N)(2(2oxopyrrolidin1yl)ethyl)3(345trimethoxyphenyl)propanamide
3((SE)1416dihydroxy3methyl17dioxo345678910octahydro1Hbenzo(c)(1)oxacyclotetradecin15yl)N(2(2oxopyrrolidin1yl)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)NCCN1CCCC1=O
InChI=1SC36H46N2O10c1221081325(39)1275611231827(40)33(34(43)32(23)36(44)4822)26(2130(41)371517381691431(38)42)241928(452)35(474)29(2024)463h611182022264043H5710121721H214H3(H3741)b116+t2226?m0s1
ZINC001547138256
ZINC001547138257

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Available files

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