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Prost-13-en-1-oic acid, 11,15-dihydroxy-7,9-dioxo-, ethyl ester, (11.alpha.,13E,15S)-(.+-.)-
SpectraBase Compound ID 86tkmJiPsud
InChI InChI=1S/C22H36O6/c1-3-5-7-10-16(23)13-14-17-19(25)15-20(26)22(17)18(24)11-8-6-9-12-21(27)28-4-2/h13-14,16-17,19,22-23,25H,3-12,15H2,1-2H3/b14-13+/t16-,17-,19+,22-/m0/s1
InChIKey OAMLLGFRADLIKE-ZKHAQOJCSA-N
Mol Weight 396.5 g/mol
Molecular Formula C22H36O6
Exact Mass 396.251189 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DW8yiQldxB6
Name Prost-13-en-1-oic acid, 11,15-dihydroxy-7,9-dioxo-, ethyl ester, (11.alpha.,13E,15S)-(.+-.)-
Alternate Name(s) 7-Oxoprostaglandin E1 ethyl ester Ethyl (11beta,13E,15S)-11,15-dihydroxy-7,9-dioxoprost-13-en-1-oate Mixture of (DL)7oxo-15-epi-ent-prostaglandin E1 ethyl ester and 7-oxo-prostaglandin E1 ethyl ester
CAS Registry Number 56761-19-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H36O6
InChI InChI=1S/C22H36O6/c1-3-5-7-10-16(23)13-14-17-19(25)15-20(26)22(17)18(24)11-8-6-9-12-21(27)28-4-2/h13-14,16-17,19,22-23,25H,3-12,15H2,1-2H3/b14-13+/t16-,17-,19+,22-/m0/s1
InChIKey OAMLLGFRADLIKE-ZKHAQOJCSA-N
Molecular Weight 396.524 g/mol
SMILES O[C@](\C=C\[C@@]1([C@](C(C[C@]1(O)[H])=O)(C(=O)CCCCCC(=O)OCC)[H])[H])(CCCCC)[H]
SPLASH splash10-06r6-5209000000-738a9f851faa09dc6430
Source of Spectrum F-33-1110-0
Wiley ID 1367484