EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C9H17NO5 |
| Net Charge | 0 |
| Average Mass | 219.237 |
| Monoisotopic Mass | 219.11067 |
| SMILES | CC(C)(CO)[C@@H](O)C(=O)NCCC(=O)O |
| InChI | InChI=1S/C9H17NO5/c1-9(2,5-11)7(14)8(15)10-4-3-6(12)13/h7,11,14H,3-5H2,1-2H3,(H,10,15)(H,12,13)/t7-/m0/s1 |
| InChIKey | GHOKWGTUZJEAQD-ZETCQYMHSA-N |
| Wikipedia |
|---|
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Chlamydomonas reinhardtii (ncbitaxon:3055) | |||
| - | MetaboLights (MTBLS208) | From MetaboLights | |
| - | MetaboLights (MTBLS37) | From MetaboLights | |
| Glycine max (ncbitaxon:3847) | - | MetaboLights (MTBLS117) | From MetaboLights |
| Homo sapiens (ncbitaxon:9606) | |||
| blood serum (BTO:0000133) | MetaboLights (MTBLS90) | ||
| blood serum (BTO:0000133) | MetaboLights (MTBLS90) | From MetaboLights | |
| blood serum (BTO:0000133) | MetaboLights (MTBLS152) | From MetaboLights |
| Roles Classification |
|---|
| Biological Roles: | human blood serum metabolite Any metabolite (endogenous or exogenous) found in human blood serum samples. plant metabolite Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms. water-soluble vitamin (role) Any vitamin that dissolves in water and readily absorbed into tissues for immediate use. Unlike the fat-soluble vitamins, they are not stored in the body and need to be replenished regularly in the diet and will rarely accumulate to toxic levels since they are quickly excreted from the body via urine. cofactor An organic molecule or ion (usually a metal ion) that is required by an enzyme for its activity. It may be attached either loosely (coenzyme) or tightly (prosthetic group). water-soluble vitamin (role) Any vitamin that dissolves in water and readily absorbed into tissues for immediate use. Unlike the fat-soluble vitamins, they are not stored in the body and need to be replenished regularly in the diet and will rarely accumulate to toxic levels since they are quickly excreted from the body via urine. water-soluble vitamin (role) Any vitamin that dissolves in water and readily absorbed into tissues for immediate use. Unlike the fat-soluble vitamins, they are not stored in the body and need to be replenished regularly in the diet and will rarely accumulate to toxic levels since they are quickly excreted from the body via urine. cofactor An organic molecule or ion (usually a metal ion) that is required by an enzyme for its activity. It may be attached either loosely (coenzyme) or tightly (prosthetic group). |
| Applications: | geroprotector Any compound that supports healthy aging, slows the biological aging process, or extends lifespan. antidote to curare poisoning A role borne by a molecule that acts to counteract or neutralize the deleterious effects of curare. nutraceutical A product in capsule, tablet or liquid form that provide essential nutrients, such as a vitamin, an essential mineral, a protein, an herb, or similar nutritional substance. |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| (R)-pantothenic acid (CHEBI:46905) has role antidote to curare poisoning (CHEBI:74530) |
| (R)-pantothenic acid (CHEBI:46905) has role geroprotector (CHEBI:176497) |
| (R)-pantothenic acid (CHEBI:46905) has role human blood serum metabolite (CHEBI:85234) |
| (R)-pantothenic acid (CHEBI:46905) is a pantothenic acid (CHEBI:7916) |
| (R)-pantothenic acid (CHEBI:46905) is a vitamin B5 (CHEBI:176840) |
| (R)-pantothenic acid (CHEBI:46905) is conjugate acid of (R)-pantothenate (CHEBI:29032) |
| Incoming Relation(s) |
| (R)-4'-phosphonatopantothenate(3−) (CHEBI:10986) has functional parent (R)-pantothenic acid (CHEBI:46905) |
| (R)-4'-phosphopantothenate(1−) (CHEBI:12886) has functional parent (R)-pantothenic acid (CHEBI:46905) |
| (R)-4'-phosphopantothenate(2−) (CHEBI:20891) has functional parent (R)-pantothenic acid (CHEBI:46905) |
| (R)-4'-phosphopantothenic acid (CHEBI:15905) has functional parent (R)-pantothenic acid (CHEBI:46905) |
| vitamin B complex (CHEBI:75782) has part (R)-pantothenic acid (CHEBI:46905) |
| (R)-pantothenate (CHEBI:29032) is conjugate base of (R)-pantothenic acid (CHEBI:46905) |
| IUPAC Name |
|---|
| 3-[(2R)-2,4-dihydroxy-3,3-dimethylbutanamido]propanoic acid |
| Synonyms | Source |
|---|---|
| chick antidermatitis factor | ChemIDplus |
| (R)-N-(2,4-dihydroxy-3,3-dimethyl-1-oxobutyl)-β-alanine | ChemIDplus |
| N-[(2R)-2,4-dihydroxy-3,3-dimethylbutanoyl]-beta-alanine | PDBeChem |
| (+)-Pantothenic acid | HMDB |
| Pantothenic acid | KEGG COMPOUND |
| PANTOTHENOIC ACID | PDBeChem |
| Manual Xrefs | Databases |
|---|---|
| 2055 | DrugCentral |
| C00001550 | KNApSAcK |
| C00864 | KEGG COMPOUND |
| D07413 | KEGG DRUG |
| DB01783 | DrugBank |
| FDB008322 | FooDB |
| HMDB0000210 | HMDB |
| PANTOTHENATE | MetaCyc |
| Pantothenic_Acid | Wikipedia |
| PAU | PDBeChem |
| Citations |
|---|