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(-)-3-O-palmitoylloliolide
SpectraBase Compound ID LFvLEib5lXY
InChI InChI=1S/C27H46O4/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-24(28)30-22-20-26(2,3)23-19-25(29)31-27(23,4)21-22/h19,22H,5-18,20-21H2,1-4H3/t22-,27+/m0/s1
InChIKey TUSWWSUBXAJODB-WXVAWEFUSA-N
Mol Weight 434.7 g/mol
Molecular Formula C27H46O4
Exact Mass 434.33961 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2hXWpznStBF
Name (-)-3-O-palmitoylloliolide
Appearance Colorless gum
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H46O4
InChI InChI=1S/C27H46O4/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-24(28)30-22-20-26(2,3)23-19-25(29)31-27(23,4)21-22/h19,22H,5-18,20-21H2,1-4H3/t22-,27+/m0/s1
InChIKey TUSWWSUBXAJODB-WXVAWEFUSA-N
Instrument Name HP 5988A
Ionization Type EI
Literature Reference DOI 10.1021/np1004505
Molecular Weight 434.661 g/mol
Optical Rotation [a]D20 = -34 (c = 1.00, CHCl3)
Reported Formula C27H46O4
SMILES [C@@]1(OC(=O)CCCCCCCCCCCCCCC)(CC(C)(C)C2=CC(=O)O[C@@]2(C1)C)[H]
SPLASH splash10-054o-9700000000-bf9aa3f64ee4ff21d564
Source of Spectrum G4-73-1956-Compound 6
Wiley ID 1848895