CHEBI:71621 - bacilysocin

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ChEBI Name bacilysocin
ChEBI ID CHEBI:71621
Definition A carboxylic ester resulting from the formal condensation of the carboxylic acid group of 12-methyltetradecanoic acide with one of the primary alcoholic hydroxy groups of glycerophosphoglycerol. An antibiotic obtained from Bacillus subtilis 168, it has particular activity against certain fungi. The stereochemistries of the hydroxy groups at positions C-2 and C-2' and the methyl group at position C-12 have not been determined.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C21H43O9P
Net Charge 0
Average Mass 470.53450
Monoisotopic Mass 470.26447
InChI InChI=1S/C21H43O9P/c1-3-18(2)12-10-8-6-4-5-7-9-11-13-21(25)28-15-20(24)17-30-31(26,27)29-16-19(23)14-22/h18-20,22-24H,3-17H2,1-2H3,(H,26,27)
InChIKey DIGHTWUQPWHBPG-UHFFFAOYSA-N
SMILES CCC(C)CCCCCCCCCCC(=O)OCC(O)COP(O)(=O)OCC(O)CO
Roles Classification
Biological Role(s): antimicrobial agent
A substance that kills or slows the growth of microorganisms, including bacteria, viruses, fungi and protozoans.
antibacterial agent
A substance (or active part thereof) that kills or slows the growth of bacteria.
antifungal agent
An antimicrobial agent that destroys fungi by suppressing their ability to grow or reproduce.
metabolite
Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
mouse metabolite
Any mammalian metabolite produced during a metabolic reaction in a mouse (Mus musculus).
(via monoacylglycerol phosphate )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing bacilysocin (CHEBI:71621) has functional parent 12-methyltetradecanoic acid (CHEBI:39251)
bacilysocin (CHEBI:71621) has role antibacterial agent (CHEBI:33282)
bacilysocin (CHEBI:71621) has role antifungal agent (CHEBI:35718)
bacilysocin (CHEBI:71621) has role antimicrobial agent (CHEBI:33281)
bacilysocin (CHEBI:71621) has role metabolite (CHEBI:25212)
bacilysocin (CHEBI:71621) is a carboxylic ester (CHEBI:33308)
bacilysocin (CHEBI:71621) is a glycerophosphoglycerols (CHEBI:24360)
bacilysocin (CHEBI:71621) is a monoacylglycerol phosphate (CHEBI:16961)
IUPAC Name
3-{[(2,3-dihydroxypropoxy)(hydroxy)phosphoryl]oxy}-2-hydroxypropyl 12-methyltetradecanoate
Synonym Source
1-(12-methyltetradecanoyl)-3-phosphoglyceroglycerol ChEBI
Registry Number Type Source
10044462 Reaxys Registry Number Reaxys
Citation Waiting for Citations Type Source
11796336 PubMed citation Europe PMC
Last Modified
17 January 2013