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(10E,14E)-16-(5-methoxy-3-methyl-2-oxidanyl-phenyl)-2,6,10,14-tetramethyl-4,12-bis(oxidanyl)hexadeca-2,10,14-trien-5-one
SpectraBase Compound ID II7pXkaKMyo
InChI InChI=1S/C28H42O5/c1-18(2)13-26(30)28(32)21(5)10-8-9-19(3)14-24(29)15-20(4)11-12-23-17-25(33-7)16-22(6)27(23)31/h11,13-14,16-17,21,24,26,29-31H,8-10,12,15H2,1-7H3/b19-14+,20-11+
InChIKey DDLNEFCPSLEGBF-XNXVHQMYSA-N
Mol Weight 458.6 g/mol
Molecular Formula C28H42O5
Exact Mass 458.303224 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1mcSFYkb8wo
Name (10E,14E)-16-(5-methoxy-3-methyl-2-oxidanyl-phenyl)-2,6,10,14-tetramethyl-4,12-bis(oxidanyl)hexadeca-2,10,14-trien-5-one
CAS Registry Number 85873-07-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C28H42O5
InChI InChI=1S/C28H42O5/c1-18(2)13-26(30)28(32)21(5)10-8-9-19(3)14-24(29)15-20(4)11-12-23-17-25(33-7)16-22(6)27(23)31/h11,13-14,16-17,21,24,26,29-31H,8-10,12,15H2,1-7H3/b19-14+,20-11+
InChIKey DDLNEFCPSLEGBF-XNXVHQMYSA-N
Molecular Weight 458.639 g/mol
SMILES Oc1c(C\C=C\(CC(\C=C\(CCCC(C(C(C=C(C)C)O)=O)C)C)O)C)cc(cc1C)OC
SPLASH splash10-0f7x-4900000000-85f2ce1096c9de056cbd
Source of Spectrum F-39-637-0
Synonyms (10E,14E)-4,12-dihydroxy-16-(2-hydroxy-5-methoxy-3-methyl-phenyl)-2,6,10,14-tetramethyl-hexadeca-2,10,14-trien-5-one (10E,14E)-4,12-dihydroxy-16-(2-hydroxy-5-methoxy-3-methylphenyl)-2,6,10,14-tetramethyl-5-hexadeca-2,10,14-trienone
Wiley ID 1389973