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Prost-13-en-1-oic acid, 11,15,19-trihydroxy-9-oxo-, methyl ester, (11.alpha.,13Z,15R,19S)-(.+-.)-
SpectraBase Compound ID AhbEhWV4N7F
InChI InChI=1S/C21H36O6/c1-15(22)8-7-9-16(23)12-13-18-17(19(24)14-20(18)25)10-5-3-4-6-11-21(26)27-2/h12-13,15-18,20,22-23,25H,3-11,14H2,1-2H3/b13-12-/t15-,16+,17+,18+,20+/m0/s1
InChIKey TVIRFASMEDWZOY-MXWKGGHHSA-N
Mol Weight 384.5 g/mol
Molecular Formula C21H36O6
Exact Mass 384.251189 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LEu1GPG5A2y
Name Prost-13-en-1-oic acid, 11,15,19-trihydroxy-9-oxo-, methyl ester, (11.alpha.,13Z,15R,19S)-(.+-.)-
CAS Registry Number 68216-33-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H36O6
InChI InChI=1S/C21H36O6/c1-15(22)8-7-9-16(23)12-13-18-17(19(24)14-20(18)25)10-5-3-4-6-11-21(26)27-2/h12-13,15-18,20,22-23,25H,3-11,14H2,1-2H3/b13-12-/t15-,16+,17+,18+,20+/m0/s1
InChIKey TVIRFASMEDWZOY-MXWKGGHHSA-N
Molecular Weight 384.513 g/mol
SMILES O[C@@]1(CC([C@@]([C@]1(\C=C/[C@@](CCC[C@@](O)(C)[H])(O)[H])[H])(CCCCCCC(=O)OC)[H])=O)[H]
SPLASH splash10-0aos-8491000000-a2bee7cd7131daad40c1
Source of Spectrum C-100-6215-0
Synonyms Methyl (11beta,13Z,15R,19S)-11,15,19-trihydroxy-9-oxoprost-13-en-1-oate Methyl(+,-)-9-oxo-11.alpha.,15.alpha.,19.alpha./.beta.-trihydroxy prost-13-cis-enoate
Wiley ID 1361582