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CHEBI:66688 - mediomycin B

ChEBI IDCHEBI:66688
ChEBI Namemediomycin B
Stars
DefinitionA polyene antibiotic isolated from Streptomyces mediocidicus ATCC23936 and has been shown to exhibit a broad spectrum of antifungal activity.
Last Modified5 April 2013
DownloadsMolfile
FormulaC62H97NO15
Net Charge0
Average Mass1096.450
Monoisotopic Mass1095.68582
SMILESC/C(=C\C=C\C=C\CC/C=C/C(C)[C@H](O)[C@@H](C)[C@H](O)/C=C/C=C/C=C/C=C/C=C/C=C/CC(O)C(C)C(=O)C[C@H](O)C[C@H](O)/C=C/C[C@H](O)C[C@@H](O)C[C@H](O)/C=C/C[C@@H](O)C[C@H](O)/C=C/C[C@@H](O)C[C@@H](O)CCCN)C(=O)O
InChIInChI=1S/C62H97NO15/c1-45(27-19-15-11-10-12-16-20-28-46(2)62(77)78)61(76)48(4)59(74)37-22-18-14-9-7-5-6-8-13-17-21-36-58(73)47(3)60(75)44-57(72)43-54(69)34-25-33-53(68)42-56(71)41-52(67)32-24-31-50(65)39-49(64)29-23-30-51(66)40-55(70)35-26-38-63/h5-10,12-14,16-25,27-29,32,34,37,45,47-59,61,64-74,76H,11,15,26,30-31,33,35-36,38-44,63H2,1-4H3,(H,77,78)/b6-5+,9-7+,12-10+,13-8+,18-14+,20-16+,21-17+,27-19+,29-23+,32-24+,34-25+,37-22+,46-28+/t45?,47?,48-,49+,50+,51+,52+,53-,54+,55-,56-,57+,58?,59+,61-/m0/s1
InChIKeyNVVJCDZZKMPNHL-LMFUHVRBSA-N
Species of MetaboliteComponentSourceComments
Streptomyces mediocidicus (ncbitaxon:58352) - PubMed (17315962) Mediomycin B(syn/anti relative configuration) Strain: ATCC23936
Roles Classification
Chemical Roles:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
Biological Roles:
metabolite  Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
antifungal agent  An antimicrobial agent that destroys fungi by suppressing their ability to grow or reproduce.
antimicrobial agent  A substance that kills or slows the growth of microorganisms, including bacteria, viruses, fungi and protozoans.
ChEBI Ontology
Outgoing Relation(s)
mediomycin B (CHEBI:66688) has role antifungal agent (CHEBI:35718)
mediomycin B (CHEBI:66688) has role metabolite (CHEBI:25212)
mediomycin B (CHEBI:66688) is a amino acid (CHEBI:33709)
mediomycin B (CHEBI:66688) is a polyene antibiotic (CHEBI:26177)
mediomycin B (CHEBI:66688) is a primary amino compound (CHEBI:50994)
IUPAC Name 
(2E,4E,6E,10E,13S,14S,15R,16E,18E,20E,22E,24E,26E,33R,35S,36E,39S,41R,43S,44E,47R,49S,50E,53R,55S)-58-amino-13,15,29,33,35,39,41,43,47,49,53,55-dodecahydroxy-2,12,14,30-tetramethyl-31-oxooctapentaconta-2,4,6,10,16,18,20,22,24,26,36,44,50-tridecaenoic acid
Registry NumbersSources
Reaxys:11058771Reaxys
Citations