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alpha-{4-[(E)-3-CYCLOHEXYL-3S-HYDROXYPROPENYL]HEXAHYDRO-5alpha-HYDROXY-(Z)-3alpha,6aalpha-2H-CYCLOPENTA[b]FURAN-2-YLIDENE}-m-TOLUIC ACID, MONOSODIUM SALT

Compound with spectra: 1 NMR, and 1 FTIR

alpha-{4-[(E)-3-CYCLOHEXYL-3S-HYDROXYPROPENYL]HEXAHYDRO-5alpha-HYDROXY-(Z)-3alpha,6aalpha-2H-CYCLOPENTA[b]FURAN-2-YLIDENE}-m-TOLUIC ACID, MONOSODIUM SALT
SpectraBase Compound ID 4Wm7ZMECR8E
InChI InChI=1S/C24H30O5.Na/c25-21(16-6-2-1-3-7-16)10-9-19-20-13-18(29-23(20)14-22(19)26)12-15-5-4-8-17(11-15)24(27)28;/h4-5,8-12,16,19-23,25-26H,1-3,6-7,13-14H2,(H,27,28);/q;+1/p-1/b10-9+,18-12-;/t19?,20-,21-,22-,23+;/m1./s1
InChIKey KPQVOJYDUCZQEQ-KXWOLWCYSA-M
Mol Weight 420.48076928 g/mol
Molecular Formula C24H29NaO5
Exact Mass 420.191268 g/mol
Parent InChIKey ZLJOKYGJNOQXDP-YCXJRALGSA-M
Enantiomer InChIKey KPQVOJYDUCZQEQ-LMEXSASWSA-M

View Spectrum of alpha-{4-[(E)-3-CYCLOHEXYL-3S-HYDROXYPROPENYL]HEXAHYDRO-5alpha-HYDROXY-(Z)-3alpha,6aalpha-2H-CYCLOPENTA[b]FURAN-2-YLIDENE}-m-TOLUIC ACID, MONOSODIUM SALT

1H NMR Spectrum
Copyright Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved.
Solvent Polysol-d

View Spectrum of alpha-{4-[(E)-3-CYCLOHEXYL-3S-HYDROXYPROPENYL]HEXAHYDRO-5alpha-HYDROXY-(Z)-3alpha,6aalpha-2H-CYCLOPENTA[b]FURAN-2-YLIDENE}-m-TOLUIC ACID, MONOSODIUM SALT

FTIR Spectrum
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Source of Sample E. Frankus and S. M. A. Kim, Gruenenthal GmbH, Stolberg, Germany
Technique KBr WAFER
  • M-TOLUIC ACID, A-/4-//E/-3-CYCLO- HEXYL-3S-HYDROXYPROPENYL/HEXAHYDRO- 5A-HYDROXY-/Z/-3A,6AA-2H-CYCLOPENTA/B/- FURAN-2-YLIDENE/-, MONOSODIUM SALT
alpha-{hexahydro-5alpha-hydroxy-4-[(E)-3S-hydroxy-1-octenyl]-(Z)-3alpha,6aalpha-2H-cyclopenta[b]furan-2-ylidene-m-toluic aicd,monosodium salt
2H-Cyclopenta[b]furan-2-one, 5-(benzoyloxy)hexahydro-4-(3-hydroxy-4-phenoxy-1-butenyl)-, [3aR-[3a.alpha.,4.alpha.(1E,3R*),5.beta.,6a.alp ha.]]-
(+)-3ALPHA-(2Z-HEPTENYL)-2BETA-(3ALPHA,BETA-HYDROXY-7-ETHOXYCARBONYL-2E-HEPTENYL)-1ALPHA,4ALPHA-BIS(BENZOYLOXY)CYCLOPENTANE (ISOMER MIXTURE)
(+/-)-1-ALPHA,4-ALPHA-DIBENZOYLOXY-2-BETA-(3-HYDROXY-7-ETHOXYCARBONYL-2Z-HEPTENYL)-3-ALPHA-(2Z-6-METHOXYCARBONYL-2-HEXEN-1-YL)-CYClOPENTANE
2-Oxa-3-oxo-7-(3,8-di(trimethylsiloxy)-1-octenyl)-8-(trimethylsiloxy)bicyclo[4.3.0]nonane
(+/-)-1-ALPHA,4-ALPHA-DIBENZOYLOXY-3-ALPHA-(6-METHOXYCARBOYNL-2Z-HEXENYL)-2-BETA-(3-OXO-6-ETHOXYCARBONYL-2Z-HEPTENYL)-CYClOPENTANE
(+)-3ALPHA-(2Z-HEPTENYL)-2BETA-(3-OXO-7-ETHOXYCARBONYL-2E-HEPTENYL)-1ALPHA,4ALPHA-BIS(BENZOYLOXY)CYCLOPENTANE
(3aRS,4SR,5RS,6aSR)-3,3a,4,5,6,6a-Hexahydro-5-[(t-butyl)dimethylsilyloxy)-4-(3'-oxooct-1'-en-1'-yl)-2H-cyclopenta[b]furan-2-one
6(9)-OXY-PGF-1A ME 2TMS
Methyl (1"E,5Z)-7-[5'-Acetoxy-2'-(3-oxo-3"-trimethylsilyl-1"-propenyl)-3'-(tetrahydropyran-2"'-yloxy)-1'-cyclopentanyl]-5-heptanoate
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