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(1R,2S,3Z,4'R,5'R)-1-(4'-Methyl-4'-hydroxymethyl-2'-oxazolidinon-5'-yl)-1,2-O-isopropylidene-11-keto-3-ene-1,2-heptadecanediol
SpectraBase Compound ID 2thwDr23tpv
InChI InChI=1S/C25H43NO6/c1-5-6-7-12-15-19(28)16-13-10-8-9-11-14-17-20-21(32-24(2,3)31-20)22-25(4,18-27)26-23(29)30-22/h14,17,20-22,27H,5-13,15-16,18H2,1-4H3,(H,26,29)/b17-14-/t20-,21+,22-,25+/m0/s1
InChIKey QRWOVBZSJHKHJG-WWXDBRIVSA-N
Mol Weight 453.6 g/mol
Molecular Formula C25H43NO6
Exact Mass 453.309038 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3JKlNBoBf5I
Name (1R,2S,3Z,4'R,5'R)-1-(4'-Methyl-4'-hydroxymethyl-2'-oxazolidinon-5'-yl)-1,2-O-isopropylidene-11-keto-3-ene-1,2-heptadecanediol
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Formula C25H43NO6
InChI InChI=1S/C25H43NO6/c1-5-6-7-12-15-19(28)16-13-10-8-9-11-14-17-20-21(32-24(2,3)31-20)22-25(4,18-27)26-23(29)30-22/h14,17,20-22,27H,5-13,15-16,18H2,1-4H3,(H,26,29)/b17-14-/t20-,21+,22-,25+/m0/s1
InChIKey QRWOVBZSJHKHJG-WWXDBRIVSA-N
Molecular Weight 453.620 g/mol
SMILES N1C(O[C@]([C@]1(CO)C)([C@@]1(OC(C)(C)O[C@]1(\C=C/CCCCCCC(=O)CCCCCC)[H])[H])[H])=O
SPLASH splash10-0w2c-5901100000-6f1482e4e62b30e34ff8
Source of Spectrum J-65-9118-20
Synonyms (4R,5R)-5-[(4R,5S)-2,2-dimethyl-5-[(Z)-9-oxopentadec-1-enyl]-1,3-dioxolan-4-yl]-4-(hydroxymethyl)-4-methyl-2-oxazolidinone (4R,5R)-5-[(4R,5S)-2,2-dimethyl-5-[(Z)-9-oxopentadec-1-enyl]-1,3-dioxolan-4-yl]-4-(hydroxymethyl)-4-methyl-1,3-oxazolidin-2-one (4R,5R)-5-[(4R,5S)-2,2-dimethyl-5-[(Z)-9-oxopentadec-1-enyl]-1,3-dioxolan-4-yl]-4-(hydroxymethyl)-4-methyl-oxazolidin-2-one (4R,5R)-5-[(4R,5S)-2,2-dimethyl-5-[(Z)-9-oxidanylidenepentadec-1-enyl]-1,3-dioxolan-4-yl]-4-(hydroxymethyl)-4-methyl-1,3-oxazolidin-2-one
Wiley ID 1534059