| Record Information |
|---|
| Version | 1.0 |
|---|
| Creation date | 2015-10-09 22:29:42 UTC |
|---|
| Update date | 2017-01-19 02:36:19 UTC |
|---|
| FoodComEx ID | PC000295 |
|---|
| FoodDB Record | FDB022674 |
|---|
| Chemical Information |
|---|
| Name | dATP |
|---|
| Description | Animals obtain their energy by oxidation of foods, plants do so by trapping the sunlight using chlorophyll. However, before the energy can be used, it is first transformed into a form which the organism can handle easily. This special carrier of energy is the molecule adenosine triphosphate, or ATP. The ATP molecule is composed of three components. At the centre is a sugar molecule, [[ribose] (the same sugar that forms the basis of DNA). Attached to one side of this is a base (a group consisting of linked rings of carbon and nitrogen atoms); in this case the base is adenine. The other side of the sugar is attached to a string of phosphate groups. These phosphates are the key to the activity of ATP. ATP consists of a base, in this case adenine (red), a ribose (magenta) and a phosphate chain (blue). ATP works by losing the endmost phosphate group when instructed to do so by an enzyme. This reaction releases a lot of energy, which the organism can then use to build proteins, contact muscles, etc. [HMDB]. dATP is found in many foods, some of which are pepper (c. chinense), squashberry, safflower, and brussel sprouts. |
|---|
| CAS Number | 1927-31-7 |
|---|
| Structure | |
|---|
| Synonyms | | Synonym | Source |
|---|
| 2'-Deoxy-5'-ATP | hmdb | | 2'-Deoxy-ATP | hmdb | | 2'-Deoxyadenosine 5'-triate | ChEBI | | 2'-Deoxyadenosine 5'-triic acid | Generator | | 2'-Deoxyadenosine 5'-triphosphate | hmdb | | 2'-Deoxyadenosine triate | HMDB | | 2'-deoxyadenosine triphosphate | hmdb | | Deoxy-ATP | hmdb | | Deoxyadenosine 5'-triate | ChEBI | | Deoxyadenosine 5'-triic acid | Generator | | Deoxyadenosine 5'-triphosphate | hmdb | | Deoxyadenosine triate | ChEBI | | Deoxyadenosine triic acid | Generator | | Deoxyadenosine triphosphate | hmdb | | Deoxyadenosine-triate | HMDB | | deoxyadenosine-triphosphate | hmdb |
|
|---|
| Chemical Formula | C10H16N5O12P3 |
|---|
| IUPAC name | ({[({[(2R,3S,5R)-5-(6-amino-9H-purin-9-yl)-3-hydroxyoxolan-2-yl]methoxy}(hydroxy)phosphoryl)oxy](hydroxy)phosphoryl}oxy)phosphonic acid |
|---|
| InChI Identifier | InChI=1S/C10H16N5O12P3/c11-9-8-10(13-3-12-9)15(4-14-8)7-1-5(16)6(25-7)2-24-29(20,21)27-30(22,23)26-28(17,18)19/h3-7,16H,1-2H2,(H,20,21)(H,22,23)(H2,11,12,13)(H2,17,18,19)/t5-,6+,7+/m0/s1 |
|---|
| InChI Key | SUYVUBYJARFZHO-RRKCRQDMSA-N |
|---|
| Isomeric SMILES | NC1=NC=NC2=C1N=CN2[C@H]1C[C@H](O)[C@@H](COP(O)(=O)OP(O)(=O)OP(O)(O)=O)O1 |
|---|
| Average Molecular Weight | 491.1816 |
|---|
| Monoisotopic Molecular Weight | 491.000830537 |
|---|
| Chemical Taxonomy |
|---|
| Description | Belongs to the class of organic compounds known as purine 2'-deoxyribonucleoside triphosphates. These are purine nucleotides with triphosphate group linked to the ribose moiety lacking a hydroxyl group at position 2. |
|---|
| Kingdom | Organic compounds |
|---|
| Super Class | Nucleosides, nucleotides, and analogues |
|---|
| Class | Purine nucleotides |
|---|
| Sub Class | Purine deoxyribonucleotides |
|---|
| Direct Parent | Purine 2'-deoxyribonucleoside triphosphates |
|---|
| Alternative Parents | |
|---|
| Substituents | - Purine 2'-deoxyribonucleoside triphosphate
- 6-aminopurine
- Imidazopyrimidine
- Purine
- Aminopyrimidine
- Monoalkyl phosphate
- N-substituted imidazole
- Organic phosphoric acid derivative
- Phosphoric acid ester
- Pyrimidine
- Imidolactam
- Alkyl phosphate
- Azole
- Imidazole
- Heteroaromatic compound
- Tetrahydrofuran
- Secondary alcohol
- Azacycle
- Oxacycle
- Organoheterocyclic compound
- Organic oxygen compound
- Primary amine
- Organooxygen compound
- Organonitrogen compound
- Amine
- Organic nitrogen compound
- Organic oxide
- Organopnictogen compound
- Alcohol
- Hydrocarbon derivative
- Aromatic heteropolycyclic compound
|
|---|
| Molecular Framework | Aromatic heteropolycyclic compounds |
|---|
| External Descriptors | |
|---|
| Physico-Chemical Properties - Experimental |
|---|
| Property | Value | Reference |
|---|
| Experimental logP | Not Available | |
|---|
| Experimental Water Solubility | Not Available | |
|---|
| Melting Point | Not Available | |
|---|
|
| Foods of Origin |
|---|
| Food | Content Range | Average | Reference |
|---|
| Food | | | Reference |
|---|
|
| Production Data |
|---|
| Production Method | commercial |
|---|
| Production Method Reference | Not Available |
|---|
| Production Method Reference File | Not Available |
|---|
| Quantity Available | Production upon request, up to 50 mg |
|---|
| Delivery Time | Not Available |
|---|
| Storage Form | solid |
|---|
| Storage Conditions | -80°C |
|---|
| Stability | Not Available |
|---|
| Purity | Not Available |
|---|
| Spectra |
|---|
| Spectral Data Upon Request | Not Available |
|---|
| Provider Information |
|---|
|
| Commercial Vendors |
|---|
| AKSci | K270 |
|---|
