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Prost-13-en-1-oic acid, 11,15-dihydroxy-9-oxo-, methyl ester, (11.alpha.,13E,15S)-
SpectraBase Compound ID 42f7Hjlr5NC
InChI InChI=1S/C21H36O5/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/h13-14,16-18,20,22,24H,3-12,15H2,1-2H3/b14-13+
InChIKey QLPYHQHJKMTHED-BUHFOSPRSA-N
Mol Weight 368.5 g/mol
Molecular Formula C21H36O5
Exact Mass 368.256274 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IpEYobw2ebV
Name Prost-13-en-1-oic acid, 11,15-dihydroxy-9-oxo-, methyl ester, (11.alpha.,13E,15S)-
Alternate Name(s) Methyl (13E)-11,15-dihydroxy-9-oxoprost-13-en-1-oate 7-[3-hydroxy-2-[(E)-3-hydroxyoct-1-enyl]-5-keto-cyclopentyl]enanthic acid methyl ester 7-[3-hydroxy-2-[(E)-3-hydroxyoct-1-enyl]-5-oxocyclopentyl]heptanoic acid methyl ester Cyclopentaneheptanoic acid, 3-hydroxy-2-(3-hydroxy-1-octenyl)-5-oxo-, methyl ester, stereoisomer Methyl 7-[3-hydroxy-2-[(E)-3-hydroxyoct-1-enyl]-5-oxo-cyclopentyl]heptanoate Methyl 7-[3-oxidanyl-5-oxidanylidene-2-[(E)-3-oxidanyloct-1-enyl]cyclopentyl]heptanoate Methyl prostaglandin E1 Prostaglandin E1 methyl ester
CAS Registry Number 3434-33-1
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Formula C21H36O5
InChI InChI=1S/C21H36O5/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/h13-14,16-18,20,22,24H,3-12,15H2,1-2H3/b14-13+
InChIKey QLPYHQHJKMTHED-BUHFOSPRSA-N
Molecular Weight 368.514 g/mol
SMILES OC(\C=C\C1C(CC(C1CCCCCCC(=O)OC)=O)O)CCCCC
SPLASH splash10-0ued-0394000000-f95269b2f6a41a66e6db
Source of Spectrum DB-0-25-5
Wiley ID 1353158