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(1R,4R,6S,7S,9S,19R,10Z,12E,16E)Methyl 9-hydroxy-7-methoxy-6,16-dimethyl-3-oxo-2-oxatricyclo[17.3.1.0(4,9)]tricosa-10-12,16-triene-10-carboxylate
SpectraBase Compound ID HOCWRhpHzre
InChI InChI=1S/C27H40O6/c1-18-9-6-5-7-12-22(25(28)32-4)27(30)17-24(31-3)19(2)15-23(27)26(29)33-21-11-8-10-20(16-21)14-13-18/h5,7,12-13,19-21,23-24,30H,6,8-11,14-17H2,1-4H3/b7-5+,18-13+,22-12+/t19-,20+,21+,23-,24-,27+/m0/s1
InChIKey GIILQRZNRQFKTO-FYQWNNKGSA-N
Mol Weight 460.6 g/mol
Molecular Formula C27H40O6
Exact Mass 460.282489 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 83Xej3SYxtE
Name (1R,4R,6S,7S,9S,19R,10Z,12E,16E)Methyl 9-hydroxy-7-methoxy-6,16-dimethyl-3-oxo-2-oxatricyclo[17.3.1.0(4,9)]tricosa-10-12,16-triene-10-carboxylate
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Formula C27H40O6
InChI InChI=1S/C27H40O6/c1-18-9-6-5-7-12-22(25(28)32-4)27(30)17-24(31-3)19(2)15-23(27)26(29)33-21-11-8-10-20(16-21)14-13-18/h5,7,12-13,19-21,23-24,30H,6,8-11,14-17H2,1-4H3/b7-5+,18-13+,22-12+/t19-,20+,21+,23-,24-,27+/m0/s1
InChIKey GIILQRZNRQFKTO-FYQWNNKGSA-N
Molecular Weight 460.611 g/mol
SMILES O[C@]12[C@](C(O[C@]3(C[C@](C\C=C\(CC\C=C\C=C\2C(=O)OC)C)([H])CCC3)[H])=O)(C[C@@]([C@](C1)(OC)[H])(C)[H])[H]
SPLASH splash10-03di-0000900000-79fc75da3e19ad29c7a5
Source of Spectrum KC-1993-1504-73
Synonyms Methyl (1R,4R,6S,7S,9S,19R)-9-hydroxy-7-methoxy-6,16-dimethyl-3-oxo-2-oxatricyclo[17.3.1.0(4,9)]tricosa-10,12,16-triene-10-carboxylate (1RS,4SR,6SR,7SR,9SR,19RS,10Z,12E,16E)Methyl 9-hydroxy-7-methoxy-6,16-dimethyl-3-oxo-2-oxatricyclo[17.3.1.0(4,9)]tricosa-10-12,16-triene-10-carboxylate
Wiley ID 778170