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(1R,2S,3R,4R)-4-[(t-Butyldimethylsilyl)oxy]-2-[6'-(methoxycarbonyl)hex-2'-en-1'-yl]-3-[(2"-hydroxyheptyl)sulfanyl]-cyclopentan-1-ol

View entire compound with spectra: 1 MS (GC)

(1R,2S,3R,4R)-4-[(t-Butyldimethylsilyl)oxy]-2-[6'-(methoxycarbonyl)hex-2'-en-1'-yl]-3-[(2"-hydroxyheptyl)sulfanyl]-cyclopentan-1-ol
SpectraBase Compound ID Bf6C1w20ajz
InChI InChI=1S/C26H50O5SSi/c1-8-9-12-15-20(27)19-32-25-21(16-13-10-11-14-17-24(29)30-5)22(28)18-23(25)31-33(6,7)26(2,3)4/h10,13,20-23,25,27-28H,8-9,11-12,14-19H2,1-7H3/b13-10-/t20?,21-,22+,23+,25+/m0/s1
InChIKey GIMPLSYAWNDYGQ-VXDQFFBBSA-N
Mol Weight 502.8 g/mol
Molecular Formula C26H50O5SSi
Exact Mass 502.314822 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4diHpsccHiC
Name (1R,2S,3R,4R)-4-[(t-Butyldimethylsilyl)oxy]-2-[6'-(methoxycarbonyl)hex-2'-en-1'-yl]-3-[(2"-hydroxyheptyl)sulfanyl]-cyclopentan-1-ol
Alternate Name(s) (1S / 1R)-4-[(t-Butyldimethylsilyl)oxy]-2-[6'-(methoxycarbonyl)hex-2'-en-1'-yl]-3-[(2''-hydroxyheptyl)sulfanyl]-cyclopentan-1-ol Methyl (5Z)-7-{(1S,2R,3R,5R)-3-{[tert-butyl(dimethyl)silyl]oxy}-5-hydroxy-2-[(2-hydroxyheptyl)sulfanyl]cyclopentyl}-5-heptenoate Thiaprostaglandine-derivative
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H50O5SSi
InChI InChI=1S/C26H50O5SSi/c1-8-9-12-15-20(27)19-32-25-21(16-13-10-11-14-17-24(29)30-5)22(28)18-23(25)31-33(6,7)26(2,3)4/h10,13,20-23,25,27-28H,8-9,11-12,14-19H2,1-7H3/b13-10-/t20?,21-,22+,23+,25+/m0/s1
InChIKey GIMPLSYAWNDYGQ-VXDQFFBBSA-N
Molecular Weight 502.826 g/mol
SMILES O[C@@]1(C[C@]([C@](SCC(O)CCCCC)([C@]1(C\C=C/CCCC(=O)OC)[H])[H])(O[Si](C(C)(C)C)(C)C)[H])[H]
SPLASH splash10-05bb-9221200000-52477a54aba2921987fd
Source of Spectrum F2-113-120-10
Wiley ID 1549556