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8-Hydroxyannonacin pentaacatate
SpectraBase Compound ID 1RZA1idd9Ug
InChI InChI=1S/C45H74O13/c1-8-9-10-11-12-13-14-15-16-17-24-41(56-35(6)49)43-26-27-44(58-43)42(57-36(7)50)25-19-18-21-39(54-33(4)47)30-40(55-34(5)48)23-20-22-38(53-32(3)46)29-37-28-31(2)52-45(37)51/h28,31,38-44H,8-27,29-30H2,1-7H3
InChIKey PYEVFPXLVIDAMO-UHFFFAOYSA-N
Mol Weight 823.1 g/mol
Molecular Formula C45H74O13
Exact Mass 822.512942 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID I5sJZ7mOhh7
Name 8-Hydroxyannonacin pentaacatate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C45H74O13
InChI InChI=1S/C45H74O13/c1-8-9-10-11-12-13-14-15-16-17-24-41(56-35(6)49)43-26-27-44(58-43)42(57-36(7)50)25-19-18-21-39(54-33(4)47)30-40(55-34(5)48)23-20-22-38(53-32(3)46)29-37-28-31(2)52-45(37)51/h28,31,38-44H,8-27,29-30H2,1-7H3
InChIKey PYEVFPXLVIDAMO-UHFFFAOYSA-N
Molecular Weight 823.074 g/mol
SMILES C=1(C(OC(C1)C)=O)CC(OC(=O)C)CCCC(OC(=O)C)CC(OC(=O)C)CCCCC(C1OC(C(OC(=O)C)CCCCCCCCCCCC)CC1)OC(=O)C
SPLASH splash10-0ir0-0977000000-407a7b40220188259fcd
Source of Spectrum J-57-6202-10
Synonyms 1-{5-[1,6,8,12-tetrakis(acetyloxy)-13-(5-methyl-2-oxo-2,5-dihydrofuran-3-yl)tridecyl]oxolan-2-yl}tridecyl acetate
Wiley ID 1417458