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(1S,2S,3E,5R,6S,11S,14S,15S,17R,18S)-15,17-dihydroxy-5,6-dimethoxy-2,14,18-trimethyl-11-phenyl-12,19-dioxabicyclo[13.3.1]nonadec-3-en-13-one

View entire compound with spectra: 1 MS (GC)

(1S,2S,3E,5R,6S,11S,14S,15S,17R,18S)-15,17-dihydroxy-5,6-dimethoxy-2,14,18-trimethyl-11-phenyl-12,19-dioxabicyclo[13.3.1]nonadec-3-en-13-one
SpectraBase Compound ID 8GP0GUg7Epo
InChI InChI=1S/C28H42O7/c1-18-15-16-25(33-5)24(32-4)14-10-9-13-23(21-11-7-6-8-12-21)34-27(30)20(3)28(31)17-22(29)19(2)26(18)35-28/h6-8,11-12,15-16,18-20,22-26,29,31H,9-10,13-14,17H2,1-5H3/b16-15+/t18-,19-,20+,22+,23-,24-,25+,26-,28-/m0/s1
InChIKey KYGNGPVZDSSQQS-ATHCNRBMSA-N
Mol Weight 490.6 g/mol
Molecular Formula C28H42O7
Exact Mass 490.293054 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 10igmSOyHas
Name (1S,2S,3E,5R,6S,11S,14S,15S,17R,18S)-15,17-dihydroxy-5,6-dimethoxy-2,14,18-trimethyl-11-phenyl-12,19-dioxabicyclo[13.3.1]nonadec-3-en-13-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C28H42O7
InChI InChI=1S/C28H42O7/c1-18-15-16-25(33-5)24(32-4)14-10-9-13-23(21-11-7-6-8-12-21)34-27(30)20(3)28(31)17-22(29)19(2)26(18)35-28/h6-8,11-12,15-16,18-20,22-26,29,31H,9-10,13-14,17H2,1-5H3/b16-15+/t18-,19-,20+,22+,23-,24-,25+,26-,28-/m0/s1
InChIKey KYGNGPVZDSSQQS-ATHCNRBMSA-N
Molecular Weight 490.637 g/mol
SMILES O[C@]1([C@@]([C@]2(O[C@]([C@@](C(O[C@@](CCCC[C@@]([C@@](\C=C\[C@@]2(C)[H])(OC)[H])(OC)[H])(c2ccccc2)[H])=O)(C)[H])(C1)O)[H])(C)[H])[H]
SPLASH splash10-0a4i-4910000000-3f95f83700114ccf2efd
Source of Spectrum U-1997-250-19
Synonyms (1S,2S,3E,5R,6S,11S,14S,15S,17R,18S)-5,6-dimethoxy-2,14,18-trimethyl-15,17-bis(oxidanyl)-11-phenyl-12,19-dioxabicyclo[13.3.1]nonadec-3-en-13-one
Wiley ID 769348