3,5,3'-triiodo-L-thyronine phenolic β-D-glucuronide
Chemical Formula:
C21H19NO10I3
Molecular Weight:
826.095 Daltons
Monoisotopic Mass:
827.8299499003 Daltons
SMILES:
C(=O)([O-])C([N+])CC1(=CC(I)=C(C(I)=C1)OC3(C=CC(OC2(OC(C(=O)[O-])C(O)C(O)C(O)2))=C(I)C=3))
InChI:
1S/C21H20I3NO10/c22-9-6-8(33-17-10(23)3-7(4-11(17)24)5-12(25)19(29)30)1-2-13(9)34-21-16(28)14(26)15(27)18(35-21)20(31)32/h1-4,6,12,14-16,18,21,26-28H,5,25H2,(H,29,30)(H,31,32)/p-1/t12-,14-,15-,16+,18-,21+/m0/s1
InChIKey:
Synonyms
- triiodothyronine glucuronide
- beta-D-glucopyranosiduronic acid, 4-(4-(2-amino-2-carboxyethyl)-2,6-diiodophenoxy)-2-iodophenyl, (S)-
- T3G
Databases
MetaCyc:
CPD-11400
PubChem (CID):
90659063
Seed:
cpd22930
HMDB:
HMDB10346
MetaNetX:
MNXM14482