MiMeDB: Showing metabocard for ADP-ribose 2'-phosphate (MMDBc0048925)

Record Information

Version

1.0

Status

Detected and Quantified

Creation Date

2022-04-29 22:15:44 UTC

Update Date

2022-12-15 22:52:18 UTC

MiMeDB ID

MMDBc0048925

Metabolite Identification

Common Name

ADP-ribose 2'-phosphate

Description

Structure

MOL SDF PDB SMILES InChI

Synonyms

Not Available

Chemical Formula

C₁₅H₂₀N₅O₁₇P₃

Average Molecular Weight

635.266

Monoisotopic Molecular Weight

635.008899518

IUPAC Name

Not Available

Traditional Name

Not Available

CAS Registry Number

26303-90-2

SMILES

Not Available

InChI Identifier

InChI=1S/C15H24N5O17P3/c16-12-7-13(18-3-17-12)20(4-19-7)14-11(35-38(25,26)27)9(23)6(33-14)2-32-39(28,29)37-40(30,31)36-15-10(24)8(22)5(1-21)34-15/h3-6,8-11,14-15,21-24H,1-2H2,(H,28,29)(H,30,31)(H2,16,17,18)(H2,25,26,27)/p-4/t5-,6-,8-,9-,10-,11-,14-,15?/m1/s1

InChI Key

OCOLIMYIUOUURJ-TYASJMOZSA-J

Chemical Taxonomy

Functional Ontology

Not Available

Physical Properties

State

Expected Solid

Predicted Properties

Not Available

Spectra

Not Available

Biological Properties

Cellular Locations

Cytoplasm
Extracellular

Biospecimen Locations

Feces

Tissue Locations

Not Available

Associated OMIM IDs

114500 (Colorectal cancer)
610247 (Eosinophilic esophagitis)

Human Proteins and Enzymes

Proteins

Human Pathways

Pathways

Name	SMPDB/PathBank

Metabolic Reactions

Reaction ID	Precursor	Product	Enzyme	Reaction Type	Data Source	Reference

Health Effects and Bioactivity

Health Outcome/Bioactivity	Metabolite Response/Effect	Related Health Condition	Evidence Type	Measured in Matrix	Data Source	Reference

Microbial Sources

Kingdom	Phylum	Total species	Hosts and Body Sites
Fungi	Ascomycota	2
	Proteobacteria	1	Human
	Firmicutes	1	Human

Exposure Sources

Source Type	Source Sub-type	Species	Data Source	Reference	Details

Host Biospecimen and Location

Host and Biospecimen	Status	Mean	Std	Min	Max	Units	Age	Sex	Health Condition	Data Source	Reference
Human Feces	Detected but not Quantified									HMDB		details

External Links

Not Available

References

Synthesis Reference

Not Available

General References

Boyer CS, Moore GA, Moldeus P: Submitochondrial localization of the NAD+ glycohydrolase. Implications for the role of pyridine nucleotide hydrolysis in mitochondrial calcium fluxes. J Biol Chem. 1993 Feb 25;268(6):4016-20. [PubMed:8382685 ]
Kim UH, Han MK, Park BH, Kim HR, An NH: Function of NAD glycohydrolase in ADP-ribose uptake from NAD by human erythrocytes. Biochim Biophys Acta. 1993 Aug 18;1178(2):121-6. doi: 10.1016/0167-4889(93)90001-6. [PubMed:8394137 ]
Noronha A, Modamio J, Jarosz Y, Guerard E, Sompairac N, Preciat G, Danielsdottir AD, Krecke M, Merten D, Haraldsdottir HS, Heinken A, Heirendt L, Magnusdottir S, Ravcheev DA, Sahoo S, Gawron P, Friscioni L, Garcia B, Prendergast M, Puente A, Rodrigues M, Roy A, Rouquaya M, Wiltgen L, Zagare A, John E, Krueger M, Kuperstein I, Zinovyev A, Schneider R, Fleming RMT, Thiele I: The Virtual Metabolic Human database: integrating human and gut microbiome metabolism with nutrition and disease. Nucleic Acids Res. 2019 Jan 8;47(D1):D614-D624. doi: 10.1093/nar/gky992. [PubMed:30371894 ]
Bansal P, Morgat A, Axelsen KB, Muthukrishnan V, Coudert E, Aimo L, Hyka-Nouspikel N, Gasteiger E, Kerhornou A, Neto TB, Pozzato M, Blatter MC, Ignatchenko A, Redaschi N, Bridge A: Rhea, the reaction knowledgebase in 2022. Nucleic Acids Res. 2022 Jan 7;50(D1):D693-D700. doi: 10.1093/nar/gkab1016. [PubMed:34755880 ]

Showing metabocard for ADP-ribose 2'-phosphate (MMDBc0048925)

MOL for #<Metabolite:0x000055b76dcc5798>

3D MOL for #<Metabolite:0x000055b76dcc5798>

3D SDF for #<Metabolite:0x000055b76dcc5798>

3D-SDF for #<Metabolite:0x000055b76dcc5798>

PDB for #<Metabolite:0x000055b76dcc5798>

3D PDB for #<Metabolite:0x000055b76dcc5798>

SMILES for #<Metabolite:0x000055b76dcc5798>

INCHI for #<Metabolite:0x000055b76dcc5798>

Structure for #<Metabolite:0x000055b76dcc5798>

3D Structure for #<Metabolite:0x000055b76dcc5798>