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79349-15-8 | triiodothyronine, reverse sulfate
CAS No: 79349-15-8 Catalog No: AG00GHE8 MDL No:
Product Description
Catalog Number:
AG00GHE8
Chemical Name:
triiodothyronine, reverse sulfate
CAS Number:
79349-15-8
IUPAC Name:
(2S)-2-amino-3-[4-(3,5-diiodo-4-sulfooxyphenoxy)-3-iodophenyl]propanoic acid
InChI:
InChI=1S/C15H12I3NO7S/c16-9-3-7(4-12(19)15(20)21)1-2-13(9)25-8-5-10(17)14(11(18)6-8)26-27(22,23)24/h1-3,5-6,12H,4,19H2,(H,20,21)(H,22,23,24)/t12-/m0/s1
InChI Key:
BWRJFXXHPZMDPS-LBPRGKRZSA-N
Properties
Complexity:
605
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
730.747g/mol
Formal Charge:
0
Heavy Atom Count:
27
Hydrogen Bond Acceptor Count:
8
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
731.034g/mol
Monoisotopic Mass:
730.747g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
145A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1
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