| Number |
mr1053 |
| Declustering Potential(DP) |
60 |
| Collision Energy(CE) |
50 |
| Observed mass(Da) |
271.0601 |
| Exact mass(Da) |
271.0601 |
| Accurate mass error(ppm) |
0.00 |
| Molecular formula |
C15H10O5 |
| Ionization model |
|
| Ret. Time(min) |
11.67 |
| Precursor ions(Q1) |
271.0601 |
| Product ions(Q3) |
153.1 |
| Main fragments |
153.1, 243.2, 229.1, 197.2, 145.2 |
| Compound |
Apigenin |
| Identification |
standard |
| class |
Flavonoid |
| Organism |
|
| Reference |
|
| CV(%) |
171.39 |
| H2 |
0.58 |
| ChEBI_ID |
CHEBI:58470 |
| Agricola Citation Links |
|
| ArrayExpress Database Links |
|
| BRAND Names |
|
| Beilstein Registry Numbers |
6979399;; |
| BioModels Database Links |
|
| CAS Registry Numbers |
|
| COMe Database Links |
|
| ChEBI ID |
|
| ChEBI Name |
apigenin-7-olate;; |
| Charge |
-1;; |
| Chinese Abstracts Citation Links |
|
| CiteXplore Citation Links |
|
| Definition |
The 7-oxoanion of apigenin;; |
| DrugBank Database Links |
|
| Formulae |
C15H9O5;; |
| Gmelin Registry Numbers |
|
| INN |
|
| IUPAC Names |
5-hydroxy-2-(4-hydroxyphenyl)-4-oxo-4H-chromen-7-olate;; |
| InChI |
InChI=1S/C15H10O5/c16-9-3-1-8(2-4-9)13-7-12(19)15-11(18)5-10(17)6-14(15)20-13/h1-7,16-18H/p-1;; |
| InChIKey |
KZNIFHPLKGYRTM-UHFFFAOYSA-M;; |
| IntAct Database Links |
|
| IntEnz Database Links |
EC 2.1.1.75;;EC 1.14.13.86;;EC 1.14.11.22;; |
| KEGG COMPOUND Database Links |
|
| KEGG DRUG Database Links |
|
| KEGG GLYCAN Database Links |
|
| LIPID MAPS class Database Links |
|
| LIPID MAPS instance Database Links |
|
| Last Modified |
27 Jun 2014;; |
| Mass |
269.22900;; |
| MolBase Database Links |
|
| PDBeChem Database Links |
|
| Patent Database Links |
|
| PubChem Database Links |
92741387;; |
| PubMed Central Citation Links |
|
| PubMed Citation Links |
|
| RESID Database Links |
|
| Reactome Database Links |
|
| Rhea Database Links |
RHEA:32755;;RHEA:20429;;RHEA:14897;; |
| SABIO-RK Database Links |
|
| SMILES |
Oc1ccc(cc1)-c1cc(=O)c2c(O)cc([O-])cc2o1;; |
| Secondary ChEBI ID |
|
| Star |
3;; |
| Synonyms |
apigenin;; |
| UM-BBD compID Database Links |
|
| UniProt Database Links |
Q9XGP7;;Q9M1V2;;Q9LRC8;;Q9H227;;Q94C57;;Q8VWZ7;;Q7XZQ8;;Q7F8T6;;Q76MR7;;Q42653;;Q38J50;;P59049;;C6TAY1;;B1P123;;A6XNC6;;A6BM07;; |
| ChEBI Image |
 |
| |
|
