MiMeDB: Showing metabocard for Cephamycin C (MMDBc0008727)

Microbial

Record Information

Version

1.0

Status

Detected and Quantified

Creation Date

2021-05-15 01:28:26 UTC

Update Date

2022-08-12 19:58:15 UTC

Metabolite ID

MMDBc0008727

Metabolite Identification

Common Name

Cephamycin C

Description

cephamycin C belongs to the class of organic compounds known as cephalosporin 3'-carbamates. These are cephalosporins that are substituted at the 3'-position by a carbamate group. Based on a literature review very few articles have been published on cephamycin C.

Structure

MOL SDF PDB SMILES InChI

Synonyms

Value	Source
Cephamycin C sodium	MeSH
Cephamycin C, (6R)-isomer	MeSH
Cephamycin C, (6R-(6alpha,7alpha,7(s*)))-isomer	MeSH
Cephamycin C, (6R-(6alpha,7alpha,7(r*)))-isomer	MeSH
Cephamycin C, monosodium salt	MeSH
Cephamycin C, sodium salt	MeSH

Molecular Formula

C₁₆H₂₂N₄O₉S

Average Mass

446.43

Monoisotopic Mass

446.110749478

IUPAC Name

Not Available

Traditional Name

Not Available

CAS Registry Number

Not Available

SMILES

Not Available

InChI Identifier

InChI=1S/C16H22N4O9S/c1-28-16(19-9(21)4-2-3-8(17)11(22)23)13(26)20-10(12(24)25)7(5-29-15(18)27)6-30-14(16)20/h8,14H,2-6,17H2,1H3,(H2,18,27)(H,19,21)(H,22,23)(H,24,25)/t8?,14?,16-/m0/s1

InChI Key

LXWBXEWUSAABOA-YQIDSGEHSA-N

Chemical Taxonomy

Description

Belongs to the class of organic compounds known as cephalosporin 3'-carbamates. These are cephalosporins that are substituted at the 3'-position by a carbamate group.

Kingdom

Organic compounds

Super Class

Organoheterocyclic compounds

Class

Lactams

Sub Class

Beta lactams

Direct Parent

Cephalosporin 3'-carbamates

Alternative Parents

Substituents

Cephalosporin 3'-carbamate
Cephamycin
N-acyl-alpha amino acid or derivatives
Alpha-amino acid
Alpha-amino acid or derivatives
Medium-chain fatty acid
Heterocyclic fatty acid
Meta-thiazine
N-acyl-amine
Fatty amide
Fatty acyl
Dicarboxylic acid or derivatives
Tertiary carboxylic acid amide
Carbamic acid ester
Carbonic acid derivative
Secondary carboxylic acid amide
Azetidine
Amino acid
Carboxamide group
Amino acid or derivatives
Azacycle
Carboxylic acid derivative
Carboxylic acid
Dialkylthioether
Hemithioaminal
Thioether
Organopnictogen compound
Organic oxygen compound
Organic nitrogen compound
Carbonyl group
Hydrocarbon derivative
Amine
Organic oxide
Primary amine
Primary aliphatic amine
Organooxygen compound
Organonitrogen compound
Aliphatic heteropolycyclic compound

Molecular Framework

Aliphatic heteropolycyclic compounds

External Descriptors

Not Available

Functional Ontology

Not Available

Physical Properties

State

Expected Solid

Predicted Properties

Not Available

Spectra

Spectrum Type	Description	Splash Key	Deposition Date	View

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

Protein ID	Protein Name	Protein Type	Uniprot ID	Species

Human Pathways

Pathways

Name	SMPDB/PathBank

Microbial Pathways

Pathways

This table shows at most 5 pathways. For the full list of associated pathways:

See All Associated Bacterial Pathways

Name	SMPDB/PathBank	Species

Metabolic Reactions

Reactions

This table shows at most 20 reactions. For the full list of associated reactions:

See All Associated Reactions

Reaction ID	Precursor	Product	Enzyme	Reaction Type	Data Source	Reference

Health Effects and Bioactivity

Health Outcome/Bioactivity	Metabolite Response/Effect	Evidence Type	Host and Biospecimen	Data Source	Reference

Microbial Sources

Superkingdom/Kingdom	Phylum	Total species	Hosts and Body Sites	Microbial Links
Bacteria	Actinobacteria	3	Human ; Human feces; Human saliva; Human urine; Human supragingival plaque; Human sputum; Human subgingival plaque	Metabolic reconstruction; Microbial culture

Exposure Sources

Other Exposures

Source Type	Data Source	Reference

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

417294

KEGG Compound ID

Not Available

BioCyc ID

Not Available

BiGG ID

Not Available

Wikipedia Link

Not Available

METLIN ID

Not Available

PubChem Compound

475326

PDB ID

Not Available

ChEBI ID

Not Available

Food Biomarker Ontology

Not Available

CMMC Knowledgebase

Not Available

References

Synthesis Reference

Not Available

General References

Showing metabocard for Cephamycin C (MMDBc0008727)

MOL for #<Metabolite:0x00007f2adf6a7960>

3D MOL for #<Metabolite:0x00007f2adf6a7960>

3D SDF for #<Metabolite:0x00007f2adf6a7960>

3D-SDF for #<Metabolite:0x00007f2adf6a7960>

PDB for #<Metabolite:0x00007f2adf6a7960>

3D PDB for #<Metabolite:0x00007f2adf6a7960>

SMILES for #<Metabolite:0x00007f2adf6a7960>

INCHI for #<Metabolite:0x00007f2adf6a7960>

Structure for #<Metabolite:0x00007f2adf6a7960>

3D Structure for #<Metabolite:0x00007f2adf6a7960>