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CHEBI:65372 - adxanthromycin B

ChEBI IDCHEBI:65372
ChEBI Nameadxanthromycin B
Stars
DefinitionA disaccharide derivative that is adxanthromycin A in which the galactosyl moiety has an additional α-D-galactosyl residue attached at position 4. It is isolated from the fermentation broth of Streptomyces.
Last Modified29 August 2012
DownloadsMolfile
FormulaC48H50O22
Net Charge0
Average Mass978.906
Monoisotopic Mass978.27937
SMILES[H][C@@]1(O[C@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)[C@H](O)[C@@H](O)[C@@H](Oc2cc3c(c(C)c2C(=O)O)C(=O)c2c(ccc(C)c2O)[C@@]3(C)OO[C@@]2(C)c3cc(O)c(C(=O)O)c(C)c3C(=O)c3c2ccc(C)c3O)O[C@@H]1CO
InChIInChI=1S/C48H50O22/c1-15-7-9-19-31(33(15)52)36(55)27-17(3)29(43(61)62)23(51)11-21(27)47(19,5)69-70-48(6)20-10-8-16(2)34(53)32(20)37(56)28-18(4)30(44(63)64)24(12-22(28)48)65-45-41(60)39(58)42(26(14-50)67-45)68-46-40(59)38(57)35(54)25(13-49)66-46/h7-12,25-26,35,38-42,45-46,49-54,57-60H,13-14H2,1-6H3,(H,61,62)(H,63,64)/t25-,26-,35+,38+,39-,40-,41-,42+,45+,46-,47-,48-/m1/s1
InChIKeyMVIOXXHCLPZAAQ-UMLDZSFSSA-N
Species of MetaboliteComponentSourceComments
Streptomyces sp. (ncbitaxon:1931) - PubMed (10344578) Strain: NA 148
Roles Classification
Chemical Roles:
oxidising agent  A substance that removes electrons from another reactant in a redox reaction.
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
Biological Roles:
antimicrobial agent  A substance that kills or slows the growth of microorganisms, including bacteria, viruses, fungi and protozoans.
metabolite  Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
ChEBI Ontology
Outgoing Relation(s)
adxanthromycin B (CHEBI:65372) has role antimicrobial agent (CHEBI:33281)
adxanthromycin B (CHEBI:65372) has role metabolite (CHEBI:25212)
adxanthromycin B (CHEBI:65372) is a anthracenes (CHEBI:46955)
adxanthromycin B (CHEBI:65372) is a dicarboxylic acid (CHEBI:35692)
adxanthromycin B (CHEBI:65372) is a disaccharide derivative (CHEBI:63353)
adxanthromycin B (CHEBI:65372) is a glycoside (CHEBI:24400)
adxanthromycin B (CHEBI:65372) is a organic peroxide (CHEBI:25702)
adxanthromycin B (CHEBI:65372) is a phenols (CHEBI:33853)
IUPAC Name 
(10S)-10-{[(9S)-3-carboxy-2,5-dihydroxy-4,6,9-trimethyl-10-oxo-9,10-dihydroanthracen-9-yl]peroxy}-3-{[4-O-(α-D-galactopyranosyl)-α-D-galactopyranosyl]oxy}-8-hydroxy-1,7,10-trimethyl-9-oxo-9,10-dihydroanthracene-2-carboxylic acid
Citations