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(3E,6S,7R,9S)-9-[(E)-3-iodanylprop-2-enyl]-13-methoxy-7-(methoxymethoxy)-6-methyl-10-oxabicyclo[10.4.0]hexadeca-1(12),3,13,15-tetraen-11-one
SpectraBase Compound ID KoPE08SQCpn
InChI InChI=1S/C22H29IO5/c1-16-8-4-5-9-17-10-6-12-19(26-3)21(17)22(24)28-18(11-7-13-23)14-20(16)27-15-25-2/h4-7,10,12-13,16,18,20H,8-9,11,14-15H2,1-3H3/b5-4+,13-7+/t16-,18-,20+/m0/s1
InChIKey FKGSBBGRDXUGSK-OBHKLSLNSA-N
Mol Weight 500.37 g/mol
Molecular Formula C22H29IO5
Exact Mass 500.105969 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4jhbDXeXFnK
Name (3E,6S,7R,9S)-9-[(E)-3-iodanylprop-2-enyl]-13-methoxy-7-(methoxymethoxy)-6-methyl-10-oxabicyclo[10.4.0]hexadeca-1(12),3,13,15-tetraen-11-one
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Formula C22H29IO5
InChI InChI=1S/C22H29IO5/c1-16-8-4-5-9-17-10-6-12-19(26-3)21(17)22(24)28-18(11-7-13-23)14-20(16)27-15-25-2/h4-7,10,12-13,16,18,20H,8-9,11,14-15H2,1-3H3/b5-4+,13-7+/t16-,18-,20+/m0/s1
InChIKey FKGSBBGRDXUGSK-OBHKLSLNSA-N
Molecular Weight 500.373 g/mol
SMILES C1(c2c(OC)cccc2C\C=C\C[C@@]([C@@](C[C@@](O1)(C\C=C\I)[H])(OCOC)[H])(C)[H])=O
SPLASH splash10-0k9i-1490300000-35fe0c237b2493549fca
Source of Spectrum H-2005-737-0
Synonyms (3E,6S,7R,9S)-9-[(E)-3-iodoallyl]-13-methoxy-7-(methoxymethoxy)-6-methyl-10-oxabicyclo[10.4.0]hexadeca-1(12),3,13,15-tetraen-11-one (3E,6S,7R,9S)-9-[(E)-3-iodoprop-2-enyl]-13-methoxy-7-(methoxymethoxy)-6-methyl-10-oxabicyclo[10.4.0]hexadeca-1(12),3,13,15-tetraen-11-one
Wiley ID 1562373