Chem N Acetyl Diiodotyrosine Ethyl Ester Infi

Compound 139
  CheckMol                        TMF02:r0:m0
MF=C13H15I2NO4 MW=503.07
 20 20  0  1  1               999 V2000
    0.0000   -0.0000   -0.0000 I   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0118   -1.4908   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -1.3252   -2.2244   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
    1.2778   -2.2362   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -2.6385   -1.4553   -0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3370   -3.7152   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
    1.2660   -3.7271   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -2.6504   -4.4488   -0.0000 I   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0473   -4.4606   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
    2.5557   -4.4725   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5439   -5.9633   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8335   -6.7087   -0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.2305   -6.6969   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.1232   -5.9515   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2187   -8.1877   -0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0828   -5.9278   -0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.4129   -6.6969   -0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.1114   -4.4370   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3962   -6.6614   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7095   -5.8923   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3 02  0  1  0  0
  2  4 01  0  1  0  0
  3  5  1  0  0  0  0
  3  6 01  0  1  0  0
  4  7 02  0  1  0  0
  6  8  1  0  0  0  0
  6  9 02  0  1  0  0
  7 10  1  0  0  0  0
 10 11  1  0  0  0  0
 11 12  1  6  0  0  0
 11 13  1  0  0  0  0
 12 14  1  0  0  0  0
 13 15  2  0  0  0  0
 13 16  1  0  0  0  0
 14 17  2  0  0  0  0
 14 18  1  0  0  0  0
 16 19  1  0  0  0  0
 19 20  1  0  0  0  0
  7  9 01  0  1  0  0
M  END

N-Acetyl diiodotyrosine ethyl ester

₹ 0.00 0.00

Chemical Name - N-Acetyl diiodotyrosine ethyl ester
Mol Weight - 503.065
Smiles - CCOC([C@H](Cc(cc1I)cc(I)c1O)NC(C)=O)=O

Property Name	Property Value
Mol Name	N-Acetyl diiodotyrosine ethyl ester
Molweight	503.065
Monoisotopic Mass	502.909055
Clogp	1.9485
Clogs	-3.903
H Acceptors	5
H Donors	2
Total Surface Area	253.67
Relative Psa	0.23905
Polar Surface Area	75.63
Druglikeness	-4.8349
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Shape Index	0.55
Molecular Flexibility	0.57091
Molecular Complexity	0.73536
Fragments	1
Non H Atoms	20
Non Ch Atoms	7
Electronegative Atoms	7
Stereo Centers	1
Rotatable Bonds	6
Rings Closures	1
Small Rings	1
Aromatic Rings	1
Aromatic Atoms	6
Sp3 Atoms	7
Symmetric Atoms	3
Amides	1
Smiles	CCOC([C@H](Cc(cc1I)cc(I)c1O)NC(C)=O)=O
InChIKey	InChI=1S/C13H15I2NO4/c1-3-20-13(19)11(16-7(2)17)6-8-4-9(14)12(18)10(15)5-8/h4-5,11,18H,3,6H2,1-2H3,(H,16,17)/t11-/m0/s1
InChI	BPKHOPGWGZAARI-NSHDSACASA-N

Copyrights

The copyrights of data, design, and listing all reserved to Global Manufacturers and its associated sites.

Company profile , trade leads and products are user generated content.

Molecule Properties are generated theoretically any objection please contact us

Shipping

Usually delivered in 3-4 days

Enter pincode for exact delivery dates/charges

Credit / Debit Card Payment

We accept all major credit / debit card for payment, you can also pay through online banking.

Cash On Delivery

If Available. Select Cash on Delivery (CoD) payment option while placing the order and later, pay in cash at the time of actual delivery of product. No advance payment needed.

Click to Load Molecule
1 - N-Acetyl diiodotyrosine ethyl ester
2 - N-Acetyl diiodotyrosine ethyl ester

Chemryt - We contribute to the Chemicals, Pharmaceutical & Biotech industry using information technology

N-Acetyl diiodotyrosine ethyl ester