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UDCA-[G#1]-COOH

Compound with spectra: 1 NMR

UDCA-[G#1]-COOH
SpectraBase Compound ID 3ZDI1ilhGQq
InChI InChI=1S/C61H94O14/c1-34(44-14-16-46-54-48(22-26-60(44,46)10)58(8)24-20-42(72-36(3)62)28-40(58)30-50(54)74-38(5)64)12-18-52(66)70-32-57(7,56(68)69)33-71-53(67)19-13-35(2)45-15-17-47-55-49(23-27-61(45,47)11)59(9)25-21-43(73-37(4)63)29-41(59)31-51(55)75-39(6)65/h34-35,40-51,54-55H,12-33H2,1-11H3,(H,68,69)/t34-,35-,40+,41+,42-,43-,44-,45-,46+,47+,48+,49+,50+,51+,54?,55?,57?,58+,59+,60-,61-/m1/s1
InChIKey LNIWIWWTFCWTTE-SYCVZPOCSA-N
Mol Weight 1051.4 g/mol
Molecular Formula C61H94O14
Exact Mass 1050.664358 g/mol
Enantiomer InChIKey LNIWIWWTFCWTTE-RYKFCYQUSA-N

View Spectrum of UDCA-[G#1]-COOH

13C NMR Spectrum
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent CDCl3
3α,7α-Dihydroxy-5β-cholan-24-oic acid, methyl ester, diacetate
METHYL-3,7-DIACETYLCHENODESOXYCHOLATE
Cholan-24-oic acid, 3,7-bis(acetyloxy)-, methyl ester, (3.alpha.,7.alpha.)-
3.alpha.,7.beta.-diacetyloxy-5.beta.-cholan-24-oic acid
N-[4N-methylpiperazin-1-yl)-3.alpha.,7.beta.-di-acetoxy-5-.beta.cholan-24-amide
Cholestan-26-oic acid, 3,7-bis(acetyloxy)-, methyl ester, (3.alpha.,5.beta.,7.alpha.)-
3α,7α-dihydroxy-5β-cholan-24-oic acid, methyl ester, 7-acetate
(3.alpha.,5.beta.,7.alpha.)-3,7-Bis(acetyloxy)-24-norcholan-23-oic acid
Methyl 3.alpha.-(acetoxy-D3)-7.alpha.-acetoxy-24-nor-5.beta.-cholanoate
Cholan-24-oic acid, 7-(acetyloxy)-3-oxo-, methyl ester, (5.beta.,7.beta.)-
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