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Annomuricin E
SpectraBase Compound ID BOhzbtx6mbo
InChI InChI=1S/C35H64O8/c1-3-4-5-6-7-8-9-10-11-14-19-31(39)33-22-23-34(43-33)32(40)21-16-20-30(38)29(37)18-15-12-13-17-28(36)25-27-24-26(2)42-35(27)41/h24,26,28-34,36-40H,3-23,25H2,1-2H3
InChIKey LPDLLEWSLYZCOC-UHFFFAOYSA-N
Mol Weight 612.9 g/mol
Molecular Formula C35H64O8
Exact Mass 612.460119 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LTwIbpdo90j
Name Annomuricin E
Alternate Name(s) 2-Methyl-4-[2,8,9,13-tetrahydroxy-13-[5-(1-hydroxytridecyl)-2-oxolanyl]tridecyl]-2H-furan-5-one 2-Methyl-4-[2,8,9,13-tetrahydroxy-13-[5-(1-hydroxytridecyl)oxolan-2-yl]tridecyl]-2H-furan-5-one 2-Methyl-4-[2,8,9,13-tetrahydroxy-13-[5-(1-hydroxytridecyl)tetrahydrofuran-2-yl]tridecyl]-2H-furan-5-one 2-Methyl-4-[2,8,9,13-tetrakis(oxidanyl)-13-[5-(1-oxidanyltridecyl)oxolan-2-yl]tridecyl]-2H-furan-5-one
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Formula C35H64O8
InChI InChI=1S/C35H64O8/c1-3-4-5-6-7-8-9-10-11-14-19-31(39)33-22-23-34(43-33)32(40)21-16-20-30(38)29(37)18-15-12-13-17-28(36)25-27-24-26(2)42-35(27)41/h24,26,28-34,36-40H,3-23,25H2,1-2H3
InChIKey LPDLLEWSLYZCOC-UHFFFAOYSA-N
Molecular Weight 612.889 g/mol
SMILES OC(CCCCCC(C(CCCC(C1OC(C(O)CCCCCCCCCCCC)CC1)O)O)O)CC=1C(OC(C1)C)=O
SPLASH splash10-054x-0279000000-ac8a5035857f0027ed83
Source of Spectrum G4-61-435-1
Wiley ID 1607175