| Number |
qtl-m1114 |
| Declustering Potential(DP) |
|
| Collision Energy(CE) |
|
| Observed mass(Da) |
|
| Exact mass(Da) |
|
| Accurate mass error(ppm) |
|
| Molecular formula |
|
| Ionization model |
|
| Ret. Time(min) |
|
| Precursor ions(Q1) |
152 |
| Product ions(Q3) |
135 |
| Main fragments |
|
| Compound |
Guanine |
| Identification |
standard |
| class |
Nucleic acid |
| Organism |
|
| Reference |
|
| CV(%) |
|
| H2 |
|
| ChEBI_ID |
CHEBI:16235 |
| Agricola Citation Links |
|
| ArrayExpress Database Links |
|
| BRAND Names |
|
| Beilstein Registry Numbers |
147911;; |
| BioModels Database Links |
BIOMD0000000015;; |
| CAS Registry Numbers |
73-40-5;; |
| COMe Database Links |
|
| ChEBI ID |
|
| ChEBI Name |
guanine;; |
| Charge |
0;; |
| Chinese Abstracts Citation Links |
|
| CiteXplore Citation Links |
|
| Definition |
A 2-aminopurine carrying a 6-oxo substituent.;; |
| DrugBank Database Links |
DB02377;; |
| Formulae |
C5H5N5O;; |
| Gmelin Registry Numbers |
431879;; |
| INN |
|
| IUPAC Names |
2-amino-1,9-dihydro-6H-purin-6-one;; |
| InChI |
InChI=1S/C5H5N5O/c6-5-9-3-2(4(11)10-5)7-1-8-3/h1H,(H4,6,7,8,9,10,11);; |
| InChIKey |
UYTPUPDQBNUYGX-UHFFFAOYSA-N;; |
| IntAct Database Links |
|
| IntEnz Database Links |
EC 3.6.3.37;;EC 3.5.4.3;;EC 2.4.2.8;;EC 2.4.2.48;;EC 2.4.2.29;;EC 2.4.2.15;;EC 2.4.2.1;; |
| KEGG COMPOUND Database Links |
|
| KEGG DRUG Database Links |
|
| KEGG GLYCAN Database Links |
|
| LIPID MAPS class Database Links |
|
| LIPID MAPS instance Database Links |
|
| Last Modified |
21 Jun 2016;; |
| Mass |
151.12630;; |
| MolBase Database Links |
|
| PDBeChem Database Links |
|
| Patent Database Links |
WO2008109417;;WO2007112754;;WO2007112518;;WO2007109582;;WO2006116629;;WO2006091905;;WO2006025796;;WO2006017208;;WO2006005064;;WO2006003440;;WO2005100338;;WO2005082896;;WO2005068465;;WO2005063751;;WO2005055940;;WO2005021538;;WO2005014554;;WO2005012256;;WO2 |
| PubChem Database Links |
8145637;; |
| PubMed Central Citation Links |
|
| PubMed Citation Links |
8930907;;8605156;;8241644;;8070089;;7677251;;7614924;;3939543;;3062020;;2927433;;2838362;;2546548;;2435586;;23857558;;22770225;;19212411;;1727385;;16352449;;15908587;;1487231;;12829005;;12088208;;12028120;;11788733;; |
| RESID Database Links |
|
| Reactome Database Links |
R-HSA-74255;;R-HSA-74249;;R-HSA-74215;;R-HSA-6782443;;R-HSA-112034;;R-HSA-109529;;R-HSA-109527;; |
| Rhea Database Links |
RHEA:43164;;RHEA:30771;;RHEA:27738;;RHEA:25424;;RHEA:24104;;RHEA:20832;;RHEA:16633;;RHEA:14665;;RHEA:13233;; |
| SABIO-RK Database Links |
81;;80;;7812;;7776;;360;;3547;;321;;195;;187;;13270;;12950;;12946;;127;;125;;12299;;11900;; |
| SMILES |
Nc1nc2[nH]cnc2c(=O)[nH]1;; |
| Secondary ChEBI ID |
CHEBI:5563;;CHEBI:24443;;CHEBI:14372;;CHEBI:14371;;CHEBI:42948;; |
| Star |
3;; |
| Synonyms |
guanine;;Stella Polaris;;Pearl Essence;;Pathocidin;;Naturon;;Natural pearl essence;;Natural White 1;;Mearlmaid AA;;Mearlmaid;;Guanine enol;;Guanin;;Gua;;GUN;;Dew Pearl;;CI Natural white 1;;C.I. Natural White 1;;6-Hydroxy-2-aminopurine;;2-amino-6-oxopurine |
| UM-BBD compID Database Links |
|
| UniProt Database Links |
Q9ZMF4;;Q9ZMD3;;Q9ZM61;;Q9ZLW0;;Q9ZLF3;;Q9ZL74;;Q9ZL14;;Q9ZL09;;Q9ZJG6;;Q9ZJ42;;Q9ZIM7;;Q9ZG89;;Q9ZE89;;Q9ZE46;;Q9ZE30;;Q9ZCP6;;Q9ZCK8;;Q9ZCI1;;Q9ZCB6;;Q9Z8W5;;Q9Z873;;Q9Z808;;Q9Z768;;Q9Z762;;Q9Z4S6;;Q9Z336;;Q9Z2K5;;Q9Z213;;Q9Z206;;Q9Z1S3;;Q9Z1I6;;Q9Z1C8; |
| ChEBI Image |
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