CHEBI:16858 - pantetheine 4'-phosphate

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name pantetheine 4'-phosphate
ChEBI ID CHEBI:16858
Stars This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs CHEBI:14736, CHEBI:7914, CHEBI:25844, CHEBI:11916, CHEBI:14735, CHEBI:14825, CHEBI:14738, CHEBI:29890
Supplier Information
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Formula C11H23N2O7PS
Net Charge 0
Average Mass 358.34936
Monoisotopic Mass 358.09636
InChI InChI=1S/C11H23N2O7PS/c1-11(2,7-20-21(17,18)19)9(15)10(16)13-4-3-8(14)12-5-6-22/h9,15,22H,3-7H2,1-2H3,(H,12,14)(H,13,16)(H2,17,18,19)
InChIKey JDMUPRLRUUMCTL-UHFFFAOYSA-N
SMILES CC(C)(COP(O)(O)=O)C(O)C(=O)NCCC(=O)NCCS
Roles Classification
Biological Role(s): 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).
(via pantothenic acids )
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.
(via pantothenic acids )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing pantetheine 4'-phosphate (CHEBI:16858) has role cofactor (CHEBI:23357)
pantetheine 4'-phosphate (CHEBI:16858) is a phosphopantetheine (CHEBI:26073)
pantetheine 4'-phosphate (CHEBI:16858) is a thiol (CHEBI:29256)
pantetheine 4'-phosphate (CHEBI:16858) is conjugate acid of pantetheine 4'-phosphate(2−) (CHEBI:47942)
Incoming D-pantetheine 4'-phosphate (CHEBI:4222) is a pantetheine 4'-phosphate (CHEBI:16858)
pantetheine 4'-phosphate(2−) (CHEBI:47942) is conjugate base of pantetheine 4'-phosphate (CHEBI:16858)
IUPAC Name
N3-[2-hydroxy-3,3-dimethyl-4-(phosphonooxy)butanoyl]-N-(2-sulfanylethyl)-β-alaninamide
Synonyms Sources
4'-Phosphopantetheine KEGG COMPOUND
Pantetheine 4'-phosphate KEGG COMPOUND
pantotheine-4'-phosphate UM-BBD
Phosphopantetheine KEGG COMPOUND
Psh-4'-P ChemIDplus
Manual Xrefs Databases
C01134 KEGG COMPOUND
DB03912 DrugBank
View more database links
Registry Number Type Source
2226-71-3 CAS Registry Number ChemIDplus
Last Modified
25 July 2019