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Details

Stereochemistry ABSOLUTE
Molecular Formula C16H11I4NO5
Molecular Weight 804.8801
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of N-FORMYL THYROXINE

SMILES

OC(=O)[C@H](CC1=CC(I)=C(OC2=CC(I)=C(O)C(I)=C2)C(I)=C1)NC=O

InChI

InChIKey=DNRNTTVIRGKKSQ-ZDUSSCGKSA-N
InChI=1S/C16H11I4NO5/c17-9-4-8(5-10(18)14(9)23)26-15-11(19)1-7(2-12(15)20)3-13(16(24)25)21-6-22/h1-2,4-6,13,23H,3H2,(H,21,22)(H,24,25)/t13-/m0/s1

HIDE SMILES / InChI

Molecular Formula C16H11I4NO5
Molecular Weight 804.8801
Charge 0
Count
MOL RATIO 1 MOL RATIO (average)
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Record UNII
4JQ6559BER
Record Status Validated (UNII)
Record Version