For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

BIS-[(7,12-DIMETHOXY-23-METHOXYCARBONYL)-CHOLANYL-3-OXY]-N,N'-XYLYLENE-DICARBAMATE

Compound with spectra: 1 NMR

BIS-[(7,12-DIMETHOXY-23-METHOXYCARBONYL)-CHOLANYL-3-OXY]-N,N'-XYLYLENE-DICARBAMATE
SpectraBase Compound ID CBw6Z4ybMJK
InChI InChI=1S/C64H100N2O12/c1-37(16-22-55(67)75-11)45-18-20-47-57-49(33-53(73-9)63(45,47)5)61(3)26-24-43(29-41(61)31-51(57)71-7)77-59(69)65-35-39-14-13-15-40(28-39)36-66-60(70)78-44-25-27-62(4)42(30-44)32-52(72-8)58-48-21-19-46(38(2)17-23-56(68)76-12)64(48,6)54(74-10)34-50(58)62/h13-15,28,37-38,41-54,57-58H,16-27,29-36H2,1-12H3,(H,65,69)(H,66,70)/t37-,38-,41+,42+,43-,44+,45-,46-,47+,48+,49+,50+,51-,52-,53+,54+,57+,58+,61+,62+,63-,64-/m1/s1
InChIKey WUQFSXLOGBOFPC-OVDDQZBGSA-N
Mol Weight 1089.5 g/mol
Molecular Formula C64H100N2O12
Exact Mass 1088.727627 g/mol
Enantiomer InChIKey WUQFSXLOGBOFPC-ANOYLUJMSA-N

View Spectrum of BIS-[(7,12-DIMETHOXY-23-METHOXYCARBONYL)-CHOLANYL-3-OXY]-N,N'-XYLYLENE-DICARBAMATE

13C NMR Spectrum
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent CDCl3
(4R)-4-[(3R,5S,7R,8R,9S,10S,12S,13R,14S,17R)-3,7,12-triformyloxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoic acid methyl ester
3-ALPHA,7-ALPHA,12-ALPHA-TRI-O-FORMYLCHOLIC-ACID
Ethyl 24-amino-3.alpha.,7.alpha.,12.alpha.-triformyroxy-27-nor-5.beta.-cholestan-26-oate
Cholic acid, 4TMS
DIETHYL-7-ALPHA,12-ALPHA-DIFORMYLOXY-3-ALPHA,24-(R)-DIHYDROXY-5-BETA-CHOLESTANE-26,27-DIOATE
DIETHYL-7-ALPHA,12-ALPHA-DIFORMYLOXY-3-ALPHA,24-(S)-DIHYDROXY-5-BETA-CHOLESTANE-26,27-DIOATE
METHYL-12-BENZYLOXY-3-HYDROXY-7-(2-METHOXYETHOXYMETHOXY)-CHOLANOATE
METHYL-7,12-BIS-[(BENZYLOXY)-METHOXY]-3-HYDROXYCHOLANOATE
Methyl ester of (3.alpha.,5.beta.,7.alpha.,12.alpha.)-12-hydroxy-3,7-bis(1-oxopropoxy)cholan-24-oic acid
Methyl ester fo (3.alpha.,5.beta.,7.beta.,12.alpha.)-3,12-bis(acetyloxy)-7-chlorocholan-24-oic acid
Title Journal or Book Year
Artificial Ion Channels Showing Rectified Current Behavior Journal of the American Chemical Society 2001
Other Resources
Unknown Identification

Search your unknown spectrum against the world's largest collection of reference spectra

KnowItAll Campus Solutions

KnowItAll offers faculty and students at your school access to all the tools you need for spectral analysis and structure drawing & publishing! Plus, access the world's largest spectral library.