3-monoiodothyronine
Chemical Formula:
C15H14NO4I
Molecular Weight:
399.184 Daltons
Monoisotopic Mass:
400.0045759751 Daltons
SMILES:
C(C(CC1(=CC(I)=C(C=C1)OC2(=CC=C(C=C2)O)))[N+])([O-])=O
InChI:
1S/C15H14INO4/c16-12-7-9(8-13(17)15(19)20)1-6-14(12)21-11-4-2-10(18)3-5-11/h1-7,13,18H,8,17H2,(H,19,20)/t13-/m0/s1
InChIKey:
Synonyms
- 3-monoiodo-L-thyronine
Databases
MetaCyc:
CPD-13009
PubChem (CID):
40418818
Seed:
cpd23694
MetaNetX:
MNXM6832