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ACTIVE PHARMA INGREDIENTS

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HTL Biotech Sodium DNA

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Chemistry

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Also known as: 9007-49-2, [5-amino-2-[[[5-amino-2-(hydroxymethyl)oxolan-3-yl]oxy-hydroxyphosphoryl]oxymethyl]oxolan-3-yl] (5-amino-3-hydroxyoxolan-2-yl)methyl hydrogen phosphate, Deoxyribonucleic acid sodium salt (salmon milt),, Dtxsid20864161, Bcp33624, Mfcd00283430

Molecular Formula

C₁₅H₃₁N₃O₁₃P₂

Molecular Weight

523.37 g/mol

InChI Key

AWBASQCACWFTGD-UHFFFAOYSA-N

A deoxyribonucleotide polymer that is the primary genetic material of all cells. Eukaryotic and prokaryotic organisms normally contain DNA in a double-stranded state, yet several important biological processes transiently involve single-stranded regions. DNA, which consists of a polysugar-phosphate backbone possessing projections of purines (adenine and guanine) and pyrimidines (thymine and cytosine), forms a double helix that is held together by hydrogen bonds between these purines and pyrimidines (adenine to thymine and guanine to cytosine).

1 2D Structure

Sodium DNA

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

[5-amino-2-[[[5-amino-2-(hydroxymethyl)oxolan-3-yl]oxy-hydroxyphosphoryl]oxymethyl]oxolan-3-yl] (5-amino-3-hydroxyoxolan-2-yl)methyl hydrogen phosphate

2.1.2 InChI

InChI=1S/C15H31N3O13P2/c16-13-1-7(20)11(28-13)5-25-32(21,22)31-9-3-15(18)29-12(9)6-26-33(23,24)30-8-2-14(17)27-10(8)4-19/h7-15,19-20H,1-6,16-18H2,(H,21,22)(H,23,24)

2.1.3 InChI Key

AWBASQCACWFTGD-UHFFFAOYSA-N

2.1.4 Canonical SMILES

C1C(C(OC1N)COP(=O)(O)OC2CC(OC2COP(=O)(O)OC3CC(OC3CO)N)N)O

2.2 Synonyms

2.2.1 MeSH Synonyms

1. Dna

2. Dna, Double Stranded

3. Dna, Double-stranded

4. Double-stranded Dna

5. Ds Dna

6. Ds-dna

2.2.2 Depositor-Supplied Synonyms

1. 9007-49-2

2. [5-amino-2-[[[5-amino-2-(hydroxymethyl)oxolan-3-yl]oxy-hydroxyphosphoryl]oxymethyl]oxolan-3-yl] (5-amino-3-hydroxyoxolan-2-yl)methyl Hydrogen Phosphate

3. Deoxyribonucleic Acid Sodium Salt (salmon Milt),

4. Dtxsid20864161

5. Bcp33624

6. Mfcd00283430

7. Dna, Double Stranded;double-stranded Dna

8. Ft-0624518

9. 5-amino-2-({[{[5-amino-2-(hydroxymethyl)oxolan-3-yl]oxy}(hydroxy)phosphoryl]oxy}methyl)oxolan-3-yl (5-amino-3-hydroxyoxolan-2-yl)methyl Hydrogen Phosphate (non-preferred Name)

2.3 Create Date

2009-08-08

3 Chemical and Physical Properties

Molecular Formula	C₁₅H₃₁N₃O₁₃P₂
Molecular Weight	523.37 g/mol
XLogP3	-10.2
Hydrogen Bond Donor Count	7
Hydrogen Bond Acceptor Count	16
Rotatable Bond Count	11
Exact Mass	g/mol
Monoisotopic Mass	g/mol
Topological Polar Surface Area	258
Heavy Atom Count	33
Formal Charge	0
Complexity	750
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	9
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently Bonded Unit Count	1