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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-[3-(pyridin-2-yl)-1,2,4-oxadiazol-5-yl]ethyl}propanamide

Catalog ID
STL562047
SMILES O=C1CCC/C=C/c2cc(O)c(c(c2C(=O)O[C@H](CCC1)C)O)C(c1ccc2c(c1)OCO2)CC(=O)NCCc1onc(n1)c1ccccn1

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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 C37H38N4O9 MW 682.73 g/mol Purity >90% as per NMR
InChI
InChI=1S/C37H38N4O9/c1-22-8-7-11-25(42)10-4-2-3-9-24-18-28(43)34(35(45)33(24)37(46)49-22)26(23-13-14-29-30(19-23)48-21-47-29)20-31(44)39-17-15-32-40-36(41-50-32)27-12-5-6-16-38-27/h3,5-6,9,12-14,16,18-19,22,26,43,45H,2,4,7-8,10-11,15,17,20-21H2,1H3,(H,39,
InChIKey
WJIGHRKKXRRMKX-RXRJTLQESA-N
Synonyms

145705399
3(13benzodioxol5yl)3((3S11E)1416dihydroxy3methyl17dioxo345678910octahydro1H2benzoxacyclotetradecin15yl)N(2(3(pyridin2yl)124oxadiazol5yl)ethyl)propanamide
3(13benzodioxol5yl)3((4S12E)1618dihydroxy4methyl28dioxo3oxabicyclo(1240)octadeca1(18)121416tetraen17yl)N(2(3pyridin2yl124oxadiazol5yl)ethyl)propanamide
3(benzo(d)(13)dioxol5yl)3((SE)1416dihydroxy3methyl17dioxo345678910octahydro1Hbenzo(c)(1)oxacyclotetradecin15yl)N(2(3(pyridin2yl)124oxadiazol5yl)ethyl)propanamide
InChI=1SC37H38N4O9c122871125(42)104239241828(43)34(35(45)33(24)37(46)4922)26(2313142930(1923)48214729)2031(44)391715324036(415032)271256163827h3569121416181922264345H2478101115172021H21H3(H3944)b93+t2226?m0s1
MFCD32651101
O=C1CCCC=Cc2cc(O)c(c(c2C(=O)O(C@H)(CCC1)C)O)C(c1ccc2c(c1)OCO2)CC(=O)NCCc1onc(n1)c1ccccn1
ZINC001848443497
ZINC001848443498

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Available files

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