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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-[(2R)-2-hydroxypropyl]propanamide

Catalog ID
STL561729
SMILES CC(CNC(=O)CC(c1c(O)cc2c(c1O)C(=O)O[C@@H](C)CCCC(=O)CCC/C=C/2)c1ccc2c(c1)OCO2)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 C31H37NO9 MW 567.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H37NO9/c1-18(33)16-32-27(36)15-23(20-11-12-25-26(14-20)40-17-39-25)29-24(35)13-21-8-4-3-5-9-22(34)10-6-7-19(2)41-31(38)28(21)30(29)37/h4,8,11-14,18-19,23,33,35,37H,3,5-7,9-10,15-17H2,1-2H3,(H,32,36)/b8-4+/t18-,19+,23?/m1/s1
InChIKey
RSRKLHIEZPSSEK-IUGKSINLSA-N
Synonyms

145705085
3(13benzodioxol5yl)3((3S11E)1416dihydroxy3methyl17dioxo345678910octahydro1H2benzoxacyclotetradecin15yl)N((2R)2hydroxypropyl)propanamide
3(13benzodioxol5yl)3((4S12E)1618dihydroxy4methyl28dioxo3oxabicyclo(1240)octadeca1(18)121416tetraen17yl)N((2R)2hydroxypropyl)propanamide
3(benzo(d)(13)dioxol5yl)3((SE)1416dihydroxy3methyl17dioxo345678910octahydro1Hbenzo(c)(1)oxacyclotetradecin15yl)N((R)2hydroxypropyl)propanamide
C(C@H)(CNC(=O)CC(c1c(O)cc2c(c1O)C(=O)O(C@@H)(C)CCCC(=O)CCCC=C2)c1ccc2c(c1)OCO2)O
InChI=1SC31H37NO9c118(33)163227(36)1523(2011122526(1420)40173925)2924(35)13218435922(34)106719(2)4131(38)28(21)30(29)37h481114181923333537H3579101517H212H3(H3236)b84+t1819+23?m1s1
MFCD32650794
ZINC001848443010
ZINC001848443011

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Available files

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