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(Z)-7-[(1R,2R,3R)-3-hydroxy-2-[(1E,3S,5Z)-3-hydroxyocta-1,5-dienyl]-5-keto-cyclopentyl]hept-5-enoic acid methyl ester
SpectraBase Compound ID FsdWkQ6Ce0W
InChI InChI=1S/C21H32O5/c1-3-4-7-10-16(22)13-14-18-17(19(23)15-20(18)24)11-8-5-6-9-12-21(25)26-2/h4-5,7-8,13-14,16-18,20,22,24H,3,6,9-12,15H2,1-2H3/b7-4-,8-5-,14-13+/t16-,17+,18+,20+/m0/s1
InChIKey PXDMIVVIKCMLCB-NTEAUVGASA-N
Mol Weight 364.5 g/mol
Molecular Formula C21H32O5
Exact Mass 364.224974 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ykRLqQ3MG
Name (Z)-7-[(1R,2R,3R)-3-hydroxy-2-[(1E,3S,5Z)-3-hydroxyocta-1,5-dienyl]-5-keto-cyclopentyl]hept-5-enoic acid methyl ester
Alternate Name(s) (Z)-7-[(1R,2R,3R)-3-hydroxy-2-[(1E,3S,5Z)-3-hydroxyocta-1,5-dienyl]-5-oxocyclopentyl]-5-heptenoic acid methyl ester Methyl (Z)-7-[(1R,2R,3R)-3-hydroxy-2-[(1E,3S,5Z)-3-hydroxyocta-1,5-dienyl]-5-oxo-cyclopentyl]hept-5-enoate Methyl (Z)-7-[(1R,2R,3R)-3-oxidanyl-5-oxidanylidene-2-[(1E,3S,5Z)-3-oxidanylocta-1,5-dienyl]cyclopentyl]hept-5-enoate
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Formula C21H32O5
InChI InChI=1S/C21H32O5/c1-3-4-7-10-16(22)13-14-18-17(19(23)15-20(18)24)11-8-5-6-9-12-21(25)26-2/h4-5,7-8,13-14,16-18,20,22,24H,3,6,9-12,15H2,1-2H3/b7-4-,8-5-,14-13+/t16-,17+,18+,20+/m0/s1
InChIKey PXDMIVVIKCMLCB-NTEAUVGASA-N
Molecular Weight 364.482 g/mol
SMILES O[C@@]1(CC([C@@]([C@]1(\C=C\[C@@](O)(C\C=C/CC)[H])[H])(C\C=C/CCCC(=O)OC)[H])=O)[H]
SPLASH splash10-0002-0091000000-dbc28ae7fd4b8dd933ef
Source of Spectrum F-48-1978-14
Wiley ID 1350923