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(S)-3-{(8R,13S)-8-Hydroxy-13-methoxymethoxy-14-[2-((R)-2-methoxymethoxy-dodecyloxy)-ethoxy]-tetradec-10-ynyl}-5-methyl-5H-furan-2-one
SpectraBase Compound ID 8OAQdclqidn
InChI InChI=1S/C37H66O9/c1-5-6-7-8-9-10-14-17-23-35(44-30-40-3)28-42-25-26-43-29-36(45-31-41-4)24-19-18-22-34(38)21-16-13-11-12-15-20-33-27-32(2)46-37(33)39/h27,32,34-36,38H,5-17,20-26,28-31H2,1-4H3/t32-,34+,35+,36-/m0/s1
InChIKey FTDMAVFFLWAQDF-YPSOBTFPSA-N
Mol Weight 654.9 g/mol
Molecular Formula C37H66O9
Exact Mass 654.470684 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID G9FCYhpeA6X
Name (S)-3-{(8R,13S)-8-Hydroxy-13-methoxymethoxy-14-[2-((R)-2-methoxymethoxy-dodecyloxy)-ethoxy]-tetradec-10-ynyl}-5-methyl-5H-furan-2-one
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Formula C37H66O9
InChI InChI=1S/C37H66O9/c1-5-6-7-8-9-10-14-17-23-35(44-30-40-3)28-42-25-26-43-29-36(45-31-41-4)24-19-18-22-34(38)21-16-13-11-12-15-20-33-27-32(2)46-37(33)39/h27,32,34-36,38H,5-17,20-26,28-31H2,1-4H3/t32-,34+,35+,36-/m0/s1
InChIKey FTDMAVFFLWAQDF-YPSOBTFPSA-N
Molecular Weight 654.926 g/mol
SMILES O[C@@](CC#CC[C@](OCOC)(COCCOC[C@](OCOC)(CCCCCCCCCC)[H])[H])(CCCCCCCC=1C(O[C@@](C)(C1)[H])=O)[H]
SPLASH splash10-004i-0090000000-d28d9e5b1dd670fc3067
Source of Spectrum QF-9-289-28
Synonyms (5S)-3-[(8R,13S,20R)-20-decyl-8-hydroxy-13-(methoxymethoxy)-15,18,21,23-tetraoxatetracos-10-yn-1-yl]-5-methyl-2(5H)-furanone 5-Methyl-3-[13-methoxymethoxy-14-[2-(2-(methoxymethoxy)dodecyloxy)ethoxy]tetradecyl]dihydrofuran-2-one
Wiley ID 1558183