D-erythrose 4-phosphate (CHEBI:48153)

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CHEBI:48153 - D-erythrose 4-phosphate

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ChEBI Name	D-erythrose 4-phosphate

ChEBI ID	CHEBI:48153

ChEBI ASCII Name	D-erythrose 4-phosphate

Definition	An erythrose phosphate that is D-erythrose carrying a phosphate group at position 4. It is an intermediate in the pentose phosphate pathway and Calvin cycle.

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

Secondary ChEBI IDs	CHEBI:42349, CHEBI:4114, CHEBI:12921

Supplier Information	ChemicalBook:CB6196808, ZINC000096077632

Download	Molfile XML SDF

more structures >>

Molfile

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21 20 0 0 0 0 999 V2000

2.4391 2.5269 -0.9522 C 0 0 0 0 0 0 0 0 0 0 0 0

2.2354 3.6481 -1.3512 O 0 0 0 0 0 0 0 0 0 0 0 0

1.5075 1.9029 0.0532 C 0 0 2 0 0 0 0 0 0 0 0 0

2.2372 1.5716 1.2367 O 0 0 0 0 0 0 0 0 0 0 0 0

0.8919 0.6340 -0.5372 C 0 0 2 0 0 0 0 0 0 0 0 0

0.1615 0.9659 -1.7203 O 0 0 0 0 0 0 0 0 0 0 0 0

-0.0533 0.0004 0.4842 C 0 0 0 0 0 0 0 0 0 0 0 0

-0.6276 -1.1838 -0.0685 O 0 0 0 0 0 0 0 0 0 0 0 0

-1.6055 -1.7949 1.0548 P 0 0 1 0 0 0 0 0 0 0 0 0

-2.6565 -0.8058 1.3841 O 0 0 0 0 0 0 0 0 0 0 0 0

-2.2918 -3.1390 0.4970 O 0 0 0 0 0 0 0 0 0 0 0 0

-0.7569 -2.1352 2.3788 O 0 0 0 0 0 0 0 0 0 0 0 0

3.2892 1.9709 -1.3185 H 0 0 0 0 0 0 0 0 0 0 0 0

0.7152 2.6097 0.3023 H 0 0 0 0 0 0 0 0 0 0 0 0

2.9265 0.9477 0.9738 H 0 0 0 0 0 0 0 0 0 0 0 0

1.6839 -0.0722 -0.7850 H 0 0 0 0 0 0 0 0 0 0 0 0

-0.5267 1.5906 -1.4568 H 0 0 0 0 0 0 0 0 0 0 0 0

0.5033 -0.2509 1.3863 H 0 0 0 0 0 0 0 0 0 0 0 0

-0.8449 0.7080 0.7329 H 0 0 0 0 0 0 0 0 0 0 0 0

-2.8685 -3.4719 1.1984 H 0 0 0 0 0 0 0 0 0 0 0 0

-0.0849 -2.7809 2.1209 H 0 0 0 0 0 0 0 0 0 0 0 0

1 2 2 0 0 0 0

1 3 1 0 0 0 0

1 13 1 0 0 0 0

3 4 1 0 0 0 0

3 5 1 0 0 0 0

3 14 1 0 0 0 0

4 15 1 0 0 0 0

5 6 1 0 0 0 0

5 7 1 0 0 0 0

5 16 1 0 0 0 0

6 17 1 0 0 0 0

7 8 1 0 0 0 0

7 18 1 0 0 0 0

7 19 1 0 0 0 0

8 9 1 0 0 0 0

9 10 2 0 0 0 0

9 11 1 0 0 0 0

9 12 1 0 0 0 0

11 20 1 0 0 0 0

12 21 1 0 0 0 0

M END): 26 ms

reading 21 atoms

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Wikipedia	License
Aspirin () is the genericized trademark for acetylsalicylic acid (ASA), a nonsteroidal anti-inflammatory drug (NSAID) used to reduce pain, fever, and inflammation, and as an antithrombotic. Specific inflammatory conditions that aspirin is used to treat include Kawasaki disease, pericarditis, and rheumatic fever. Aspirin is also used long-term to help prevent further heart attacks, ischaemic strokes, and blood clots in people at high risk. For pain or fever, effects typically begin within 30 minutes. Aspirin works similarly to other NSAIDs but also suppresses the normal functioning of platelets. One common adverse effect is an upset stomach. More significant side effects include stomach ulcers, stomach bleeding, and worsening asthma. Bleeding risk is greater among those who are older, drink alcohol, take other NSAIDs, or are on other blood thinners. Aspirin is not recommended in the last part of pregnancy. It is not generally recommended in children with infections because of the risk of Reye syndrome. High doses may result in ringing in the ears. A precursor to aspirin found in the bark of the willow tree (genus Salix) has been used for its health effects for at least 2,400 years. In 1853, chemist Charles Frédéric Gerhardt treated the medicine sodium salicylate with acetyl chloride to produce acetylsalicylic acid for the first time. Over the next 50 years, other chemists, mostly of the German company Bayer, established the chemical structure and devised more efficient production methods.: 69–75 Felix Hoffmann (or Arthur Eichengrün) of Bayer was the first to produce acetylsalicylic acid in a pure, stable form in 1897. By 1899, Bayer had dubbed this drug Aspirin and was selling it globally.: 27 Aspirin is available without medical prescription as a proprietary or generic medication in most jurisdictions. It is one of the most widely used medications globally, with an estimated 40,000 tonnes (44,000 tons) (50 to 120 billion pills) consumed each year, and is on the World Health Organization's List of Essential Medicines. In 2022, it was the 36th most commonly prescribed medication in the United States, with more than 16 million prescriptions.
Read full article at Wikipedia

Formula

C4H9O7P

Net Charge

Average Mass

200.08382

Monoisotopic Mass

200.00859

InChI

InChI=1S/C4H9O7P/c5-1-3(6)4(7)2-11-12(8,9)10/h1,3-4,6-7H,2H2,(H2,8,9,10)/t3-,4+/m0/s1

InChIKey

NGHMDNPXVRFFGS-IUYQGCFVSA-N

SMILES

[H]C(=O)[C@H](O)[C@H](O)COP(O)(O)=O

Metabolite of Species	Details
Mus musculus (NCBI:txid10090)	Source: BioModels - MODEL1507180067 See: PubMed
Escherichia coli (NCBI:txid562)	See: PubMed

Roles Classification
Biological Role(s):	Escherichia coli metabolite Any bacterial metabolite produced during a metabolic reaction in Escherichia coli. human metabolite Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens). mouse metabolite Any mammalian metabolite produced during a metabolic reaction in a mouse (Mus musculus).

View more via ChEBI Ontology

ChEBI Ontology
Outgoing	D-erythrose 4-phosphate (CHEBI:48153) has functional parent D-erythrose (CHEBI:27904) D-erythrose 4-phosphate (CHEBI:48153) has role Escherichia coli metabolite (CHEBI:76971) D-erythrose 4-phosphate (CHEBI:48153) has role human metabolite (CHEBI:77746) D-erythrose 4-phosphate (CHEBI:48153) has role mouse metabolite (CHEBI:75771) D-erythrose 4-phosphate (CHEBI:48153) is a erythrose phosphate (CHEBI:23956) D-erythrose 4-phosphate (CHEBI:48153) is conjugate acid of D-erythrose 4-phosphate(2−) (CHEBI:16897)

Incoming	D-erythrose 4-phosphate(2−) (CHEBI:16897) is conjugate base of D-erythrose 4-phosphate (CHEBI:48153)

IUPAC Names

(2R,3R)-2,3-dihydroxy-4-oxobutyl dihydrogen phosphate

D-erythrose 4-(dihydrogen phosphate)

Synonyms	Sources
4-O-phosphono-D-erythrose	IUPAC
D-Erythrose 4-phosphate	KEGG COMPOUND
ERYTHOSE-4-PHOSPHATE	PDBeChem

Manual Xrefs	Databases
C00007472	KNApSAcK
C00279	KEGG COMPOUND
DB03937	DrugBank
E4P	PDBeChem
Erythrose_4-phosphate	Wikipedia
View more database links

Registry Numbers	Types	Sources
1710821	Reaxys Registry Number	Reaxys
585-18-2	CAS Registry Number	KEGG COMPOUND
585-18-2	CAS Registry Number	ChemIDplus

Last Modified

27 January 2016

CHEBI:48153 - D-erythrose 4-phosphate

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