337609
Glycocholic acid-(glycyl-1-13C) monohydrate
99 atom % 13C
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About This Item
Empirical Formula (Hill Notation):
13CC25H43NO6 · H2O
CAS Number:
Molecular Weight:
484.63
UNSPSC Code:
12352202
PubChem Substance ID:
MDL number:
Isotopic purity:
99 atom % 13C
Mass shift:
M+1
Form:
powder
isotopic purity
99 atom % 13C
Quality Segment
form
powder
technique(s)
mass spectrometry (MS): suitable
mp
135-140 °C (lit.)
mass shift
M+1
SMILES string
O.C[C@H](CCC(=O)NC[13C](O)=O)[C@H]1CC[C@H]2[C@@H]3[C@H](O)C[C@@H]4C[C@H](O)CC[C@]4(C)[C@H]3C[C@H](O)[C@]12C
InChI
1S/C26H43NO6.H2O/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);1H2/t14-,15+,16-,17-,18+,19+,20-,21+,24+,25+,26-;/m1./s1/i23+1;
InChI key
WDKPRHOCWKLQPK-TXDHSPGBSA-N
Application
Substrate used for 13CO2 breath tests in ileal dysfunction diagnosis.
Packaging
This product may be available from bulk stock and can be packaged on demand. For information on pricing, availability and packaging, please contact Stable Isotopes Customer Service.
Storage Class
11 - Combustible Solids
wgk
WGK 3
flash_point_f
Not applicable
flash_point_c
Not applicable
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