D-pantetheine 4'-phosphate(2-) (CHEBI:61723)

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ChEBI Name	D-pantetheine 4'-phosphate(2−)

ChEBI ID	CHEBI:61723

ChEBI ASCII Name	D-pantetheine 4'-phosphate(2-)

Definition	Pantetheine 4'-phosphate(2−) with D (R) configuration at the 2' position. The dianion formed from D-pantetheine 4'-phosphate by deprotonation of the phosphate group; major microspecies at pH 7.3.

Stars	This entity has been manually annotated by the ChEBI Team.

Submitter	Kristian Axelsen

Supplier Information

Download	Molfile XML SDF

Formula

C11H21N2O7PS

Net Charge

-2

Average Mass

356.33200

Monoisotopic Mass

356.08181

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)/p-2/t9-/m0/s1

InChIKey

JDMUPRLRUUMCTL-VIFPVBQESA-L

SMILES

CC(C)(COP([O-])([O-])=O)[C@@H](O)C(=O)NCCC(=O)NCCS

Roles Classification
Biological Role(s):	prosthetic group A tightly bound, specific nonpolypeptide unit in a protein determining and involved in its biological activity. Saccharomyces cerevisiae metabolite Any fungal metabolite produced during a metabolic reaction in Baker's yeast (Saccharomyces cerevisiae ). (via pantetheine 4'-phosphate(2-) ) human metabolite Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens). (via pantetheine 4'-phosphate(2-) ) 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 pantetheine 4'-phosphate(2-) )

ChEBI Ontology
Outgoing	D-pantetheine 4'-phosphate(2−) (CHEBI:61723) has role prosthetic group (CHEBI:26348) D-pantetheine 4'-phosphate(2−) (CHEBI:61723) is a pantetheine 4'-phosphate(2−) (CHEBI:47942) D-pantetheine 4'-phosphate(2−) (CHEBI:61723) is conjugate base of D-pantetheine 4'-phosphate (CHEBI:4222)

Incoming	(R)-4'-phospho-S-sulfopantetheine(3−) (CHEBI:177302) has functional parent D-pantetheine 4'-phosphate(2−) (CHEBI:61723) (R)-4'-phosphopantetheine sulfonate(3−) (CHEBI:177300) has functional parent D-pantetheine 4'-phosphate(2−) (CHEBI:61723) D-pantetheine 4'-phosphate (CHEBI:4222) is conjugate acid of D-pantetheine 4'-phosphate(2−) (CHEBI:61723)

IUPAC Name

N³-[(2R)-2-hydroxy-3,3-dimethyl-4-(phosphonatooxy)butanoyl]-N-(2-sulfanylethyl)-β-alaninamide

Synonym	Source
(R)-4'-phosphopantetheine	UniProt

Last Modified

06 August 2021