SpectraBase Compound ID | oifydJEwwN |
---|---|
InChI | InChI=1S/C26H43NO6/c1-14(4-7-22(31)27-13-23(32)33)17-5-6-18-24-19(12-21(30)26(17,18)3)25(2)9-8-16(28)10-15(25)11-20(24)29/h14-21,24,28-30H,4-13H2,1-3H3,(H,27,31)(H,32,33)/t14-,15+,16-,17-,18+,19+,20-,21+,24+,25+,26-/m1/s1 |
InChIKey | RFDAIACWWDREDC-FRVQLJSFSA-N |
Mol Weight | 465.6 g/mol |
Molecular Formula | C26H43NO6 |
Exact Mass | 465.309038 g/mol |
SpectraBase Spectrum ID | 2aoHnbwp0Bc |
---|---|
Name | Glycocholic acid |
Source of Sample | Fluka AG, Buchs, Switzerland |
CAS Registry Number | 475-31-0 |
Comments | Tentative assignment |
Copyright | Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula | C26H43NO6 |
InChI | InChI=1S/C26H43NO6/c1-14(4-7-22(31)27-13-23(32)33)17-5-6-18-24-19(12-21(30)26(17,18)3)25(2)9-8-16(28)10-15(25)11-20(24)29/h14-21,24,28-30H,4-13H2,1-3H3,(H,27,31)(H,32,33)/t14-,15+,16-,17-,18+,19+,20-,21+,24+,25+,26-/m1/s1 |
InChIKey | RFDAIACWWDREDC-FRVQLJSFSA-N |
Molecular Weight | 465.64 |
Solvent | Polysol; Reference=TMS Spectrometer= Varian CFT-20 |