MiMeDB: Showing metabocard for undecaprenyl phosphate-4-amino-4-deoxy-L-arabinose (MMDBc0031676)

Record Information

Version

1.0

Status

Detected and Quantified

Creation Date

2021-11-18 01:43:56 UTC

Update Date

2022-08-31 18:23:00 UTC

MiMeDB ID

MMDBc0031676

Metabolite Identification

Common Name

undecaprenyl phosphate-4-amino-4-deoxy-L-arabinose

Description

Structure

MOL SDF PDB SMILES InChI

Synonyms

Value	Source
4-Amino-4-deoxy-alpha-L-arabinopyranosyl di-trans,octa-cis-undecaprenyl phosphate	ChEBI
4-Amino-4-deoxy-alpha-L-arabinopyranosyl di-trans,poly-cis-undecaprenyl phosphate zwitterion	ChEBI
4-Azaniumyl-4-deoxy-alpha-L-arabinopyranosyl di-trans,poly-cis-undecaprenyl phosphate	ChEBI
4-Amino-4-deoxy-alpha-L-arabinopyranosyl ditrans,octacis-undecaprenyl phosphate	Kegg
4-Amino-4-deoxy-a-L-arabinopyranosyl di-trans,octa-cis-undecaprenyl phosphate	Generator
4-Amino-4-deoxy-a-L-arabinopyranosyl di-trans,octa-cis-undecaprenyl phosphoric acid	Generator
4-Amino-4-deoxy-alpha-L-arabinopyranosyl di-trans,octa-cis-undecaprenyl phosphoric acid	Generator
4-Amino-4-deoxy-α-L-arabinopyranosyl di-trans,octa-cis-undecaprenyl phosphate	Generator
4-Amino-4-deoxy-α-L-arabinopyranosyl di-trans,octa-cis-undecaprenyl phosphoric acid	Generator
4-Amino-4-deoxy-a-L-arabinopyranosyl di-trans,poly-cis-undecaprenyl phosphate zwitterion	Generator
4-Amino-4-deoxy-a-L-arabinopyranosyl di-trans,poly-cis-undecaprenyl phosphoric acid zwitterion	Generator
4-Amino-4-deoxy-alpha-L-arabinopyranosyl di-trans,poly-cis-undecaprenyl phosphoric acid zwitterion	Generator
4-Amino-4-deoxy-α-L-arabinopyranosyl di-trans,poly-cis-undecaprenyl phosphate zwitterion	Generator
4-Amino-4-deoxy-α-L-arabinopyranosyl di-trans,poly-cis-undecaprenyl phosphoric acid zwitterion	Generator
4-Azaniumyl-4-deoxy-a-L-arabinopyranosyl di-trans,poly-cis-undecaprenyl phosphate	Generator
4-Azaniumyl-4-deoxy-a-L-arabinopyranosyl di-trans,poly-cis-undecaprenyl phosphoric acid	Generator
4-Azaniumyl-4-deoxy-alpha-L-arabinopyranosyl di-trans,poly-cis-undecaprenyl phosphoric acid	Generator
4-Azaniumyl-4-deoxy-α-L-arabinopyranosyl di-trans,poly-cis-undecaprenyl phosphate	Generator
4-Azaniumyl-4-deoxy-α-L-arabinopyranosyl di-trans,poly-cis-undecaprenyl phosphoric acid	Generator
4-Amino-4-deoxy-a-L-arabinopyranosyl ditrans,octacis-undecaprenyl phosphate	Generator
4-Amino-4-deoxy-a-L-arabinopyranosyl ditrans,octacis-undecaprenyl phosphoric acid	Generator
4-Amino-4-deoxy-alpha-L-arabinopyranosyl ditrans,octacis-undecaprenyl phosphoric acid	Generator
4-Amino-4-deoxy-α-L-arabinopyranosyl ditrans,octacis-undecaprenyl phosphate	Generator
4-Amino-4-deoxy-α-L-arabinopyranosyl ditrans,octacis-undecaprenyl phosphoric acid	Generator
Undecaprenyl phosphoric acid-4-amino-4-deoxy-L-arabinose	Generator
4-Amino-4-deoxy-a-L-arabinopyranosyl ditrans,polycis-undecaprenyl phosphate zwitterion	Generator
4-Amino-4-deoxy-a-L-arabinopyranosyl ditrans,polycis-undecaprenyl phosphoric acid zwitterion	Generator
4-Amino-4-deoxy-alpha-L-arabinopyranosyl ditrans,polycis-undecaprenyl phosphoric acid zwitterion	Generator
4-Amino-4-deoxy-α-L-arabinopyranosyl ditrans,polycis-undecaprenyl phosphate zwitterion	Generator
4-Amino-4-deoxy-α-L-arabinopyranosyl ditrans,polycis-undecaprenyl phosphoric acid zwitterion	Generator

Chemical Formula

C₆₀H₁₀₀NO₇P

Average Molecular Weight

978.4123

Monoisotopic Molecular Weight

977.723741071

IUPAC Name

Not Available

Traditional Name

Not Available

CAS Registry Number

Not Available

SMILES

Not Available

InChI Identifier

InChI=1S/C60H100NO7P/c1-46(2)23-13-24-47(3)25-14-26-48(4)27-15-28-49(5)29-16-30-50(6)31-17-32-51(7)33-18-34-52(8)35-19-36-53(9)37-20-38-54(10)39-21-40-55(11)41-22-42-56(12)43-44-67-69(64,65)68-60-59(63)58(62)57(61)45-66-60/h23,25,27,29,31,33,35,37,39,41,43,57-60,62-63H,13-22,24,26,28,30,32,34,36,38,40,42,44-45,61H2,1-12H3,(H,64,65)/b47-25+,48-27+,49-29-,50-31-,51-33-,52-35-,53-37-,54-39-,55-41-,56-43-/t57-,58-,59+,60-/m0/s1

InChI Key

BAFPKKRTAQMYMS-MEKAZKDWSA-N

Chemical Taxonomy

Description

Belongs to the class of organic compounds known as bactoprenol monophosphates. These are polyprenyl compounds consisting of a monophosphate group substituted by a bactoprenyl moiety.

Kingdom

Organic compounds

Super Class

Lipids and lipid-like molecules

Class

Prenol lipids

Sub Class

Polyprenols

Direct Parent

Bactoprenol monophosphates

Alternative Parents

Substituents

Polyterpenoid
Bactoprenol monophosphate
Polyprenyl monophosphate
Isoprenoid phosphate
Dialkyl phosphate
Monosaccharide
Organic phosphoric acid derivative
Oxane
Phosphoric acid ester
Alkyl phosphate
1,2-aminoalcohol
1,2-diol
Secondary alcohol
Oxacycle
Organoheterocyclic compound
Organic oxygen compound
Organic nitrogen compound
Organooxygen compound
Organonitrogen compound
Hydrocarbon derivative
Organic oxide
Primary aliphatic amine
Organopnictogen compound
Amine
Alcohol
Organic zwitterion
Primary amine
Aliphatic heteromonocyclic compound

Molecular Framework

Aliphatic heteromonocyclic compounds

External Descriptors

polyprenyl glycosyl phosphate (CHEBI:60472 )
Bactoprenol monophosphates (C16157 )

Functional Ontology

Not Available

Physical Properties

State

Expected Solid

Predicted Properties

Not Available

Spectra

Not Available

Biological Properties

Cellular Locations

Not Available

Biospecimen Locations

Not Available

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

Not Available

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	Microbial Links
	Proteobacteria	1	Human	Unknown

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

External Links

HMDB ID

Not Available

DrugBank ID

Not Available

Phenol Explorer Compound ID

Not Available

FooDB ID

Not Available

KNApSAcK ID

Not Available

Chemspider ID

Not Available

KEGG Compound ID

C16157

BioCyc ID

Not Available

BiGG ID

Not Available

Wikipedia Link

Not Available

METLIN ID

Not Available

PubChem Compound

44229075

PDB ID

Not Available

ChEBI ID

60463

Food Biomarker Ontology

Not Available

References

Synthesis Reference

Not Available

General References

Winder CL, Dunn WB, Schuler S, Broadhurst D, Jarvis R, Stephens GM, Goodacre R: Global metabolic profiling of Escherichia coli cultures: an evaluation of methods for quenching and extraction of intracellular metabolites. Anal Chem. 2008 Apr 15;80(8):2939-48. doi: 10.1021/ac7023409. Epub 2008 Mar 11. [PubMed:18331064 ]

Showing metabocard for undecaprenyl phosphate-4-amino-4-deoxy-L-arabinose (MMDBc0031676)

MOL for #<Metabolite:0x000055b76dd760e8>

3D MOL for #<Metabolite:0x000055b76dd760e8>

3D SDF for #<Metabolite:0x000055b76dd760e8>

3D-SDF for #<Metabolite:0x000055b76dd760e8>

PDB for #<Metabolite:0x000055b76dd760e8>

3D PDB for #<Metabolite:0x000055b76dd760e8>

SMILES for #<Metabolite:0x000055b76dd760e8>

INCHI for #<Metabolite:0x000055b76dd760e8>

Structure for #<Metabolite:0x000055b76dd760e8>

3D Structure for #<Metabolite:0x000055b76dd760e8>