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34957-08-9 | lecithin-bound iodine
CAS No: 34957-08-9 Catalog No: AG00D1UM MDL No:
Product Description
Catalog Number:
AG00D1UM
Chemical Name:
lecithin-bound iodine
CAS Number:
34957-08-9
IUPAC Name:
[2-(10,11,13,14,16,17-hexaiodooctadecanoyloxy)-3-(9,10,12,13-tetraiodooctadecanoyloxy)propyl] 2-(trimethylazaniumyl)ethyl phosphate
InChI:
InChI=1S/C44H78I10NO8P/c1-6-7-15-20-34(46)38(50)28-39(51)35(47)22-17-12-10-14-18-23-43(56)60-30-33(31-62-64(58,59)61-26-25-55(3,4)5)63-44(57)24-19-13-9-8-11-16-21-36(48)40(52)29-42(54)41(53)27-37(49)32(2)45/h32-42H,6-31H2,1-5H3
InChI Key:
DXTNHIMTUBDPTM-UHFFFAOYSA-N
UNII:
UX71ZI971X
Properties
Complexity:
1240
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
2048.591g/mol
Formal Charge:
0
Heavy Atom Count:
64
Hydrogen Bond Acceptor Count:
8
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
2049.125g/mol
Monoisotopic Mass:
2048.591g/mol
Rotatable Bond Count:
44
Topological Polar Surface Area:
111A^2
Undefined Atom Stereocenter Count:
11
Undefined Bond Stereocenter Count:
0
XLogP3:
20.2
Literature
| Title | Journal |
|---|---|
| Anti-goitrous effect of lecithin-bound iodine in propylthiouracil treated rats. | Endocrine regulations 20000601 |
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