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(Q106029232)
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thyronine
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
0 references
mass
273.10010796
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₅H₁₅NO₄
1 reference
based on heuristic
inferred from SMILES
canonical SMILES
NC(Cc1ccc(Oc2ccc(O)cc2)cc1)C(=O)O
1 reference
based on heuristic
inferred from InChI
Identifiers
InChI
InChI=1S/C15H15NO4/c16-14(15(18)19)9-10-1-5-12(6-2-10)20-13-7-3-11(17)4-8-13/h1-8,14,17H,9,16H2,(H,18,19)
1 reference
stated in
ChEBI release 2021-03-01
InChIKey
KKCIOUWDFWQUBT-UHFFFAOYSA-N
1 reference
stated in
ChEBI release 2021-03-01
CAS Registry Number
1034-10-2
1 reference
stated in
CAS (formerly Chemical Abstracts Service)
retrieved
25 January 2022
PubChem CID
102544
2 references
stated in
ChEBI release 2021-03-01
matched by identifier from
InChIKey
InChIKey
KKCIOUWDFWQUBT-UHFFFAOYSA-N
ChEBI ID
30661
mapping relation type
exact match
2 references
stated in
ChEBI release 2021-03-01
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C15H15NO4/c16-14(15(18)19)9-10-1-5-12(6-2-10)20-13-7-3-11(17)4-8-13/h1-8,14,17H,9,16H2,(H,18,19)
UniChem compound ID
1105481
1 reference
stated in
UniChem
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