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3-(1,3-benzodioxol-5-yl)-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-dimethoxyethyl)propanamide

Catalog ID
STL561521
SMILES COC(CNC(=O)CC(c1c(O)cc2c(c1O)C(=O)O[C@@H](C)CCCC(=O)CCC/C=C/2)c1ccc2c(c1)OCO2)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 C32H39NO10 MW 597.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H39NO10/c1-19-8-7-11-22(34)10-6-4-5-9-21-14-24(35)30(31(37)29(21)32(38)43-19)23(16-27(36)33-17-28(39-2)40-3)20-12-13-25-26(15-20)42-18-41-25/h5,9,12-15,19,23,28,35,37H,4,6-8,10-11,16-18H2,1-3H3,(H,33,36)/b9-5+/t19-,23?/m0/s1
InChIKey
KJKGYZUBQQYEIF-XZIFBKCISA-N
Synonyms

145704878
3(13benzodioxol5yl)3((3S11E)1416dihydroxy3methyl17dioxo345678910octahydro1H2benzoxacyclotetradecin15yl)N(22dimethoxyethyl)propanamide
3(13benzodioxol5yl)3((4S12E)1618dihydroxy4methyl28dioxo3oxabicyclo(1240)octadeca1(18)121416tetraen17yl)N(22dimethoxyethyl)propanamide
3(benzo(d)(13)dioxol5yl)3((SE)1416dihydroxy3methyl17dioxo345678910octahydro1Hbenzo(c)(1)oxacyclotetradecin15yl)N(22dimethoxyethyl)propanamide
COC(CNC(=O)CC(c1c(O)cc2c(c1O)C(=O)O(C@@H)(C)CCCC(=O)CCCC=C2)c1ccc2c(c1)OCO2)OC
InChI=1SC32H39NO10c119871122(34)106459211424(35)30(31(37)29(21)32(38)4319)23(1627(36)331728(392)403)2012132526(1520)42184125h5912151923283537H46810111618H213H3(H3336)b95+t1923?m0s1
MFCD32650587
ZINC001848442819
ZINC001848442820

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Available files

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