pradimicin B (CHEBI:8350)

CHEBI:8350 - pradimicin B

ChEBI ID	CHEBI:8350
ChEBI Name	pradimicin B
Stars
Definition	A member of the class of prodimicins that is isolated from the cultured broth of Actinomadura hibisca No. P157-2 (ATCC 53557).
Last Modified	28 November 2014
Downloads	Molfile

Formula	C35H36N2O14
Net Charge	0
Average Mass	708.673
Monoisotopic Mass	708.21665
SMILES	CN[C@@H]1[C@H](O)[C@@H](O)[C@H](O[C@H]2c3cc(C)c(C(=O)N[C@H](C)C(=O)O)c(O)c3-c3c(cc4c(c3O)C(=O)c3cc(OC)cc(O)c3C4=O)[C@@H]2O)O[C@@H]1C
InChI	InChI=1S/C35H36N2O14/c1-10-6-17-22(28(42)19(10)33(46)37-11(2)34(47)48)21-15(27(41)32(17)51-35-31(45)30(44)24(36-4)12(3)50-35)9-16-23(29(21)43)26(40)14-7-13(49-5)8-18(38)20(14)25(16)39/h6-9,11-12,24,27,30-32,35-36,38,41-45H,1-5H3,(H,37,46)(H,47,48)/t11-,12-,24+,27+,30+,31-,32+,35+/m1/s1
InChIKey	DHQWPIXFALDZDJ-LPEZYDJLSA-N

Species of Metabolite	Component	Source	Comments
Actinomadura hibisca (ncbitaxon:68565)	-	DOI (10.1021/jo00272a013)	Strain: ATCC 53557

Roles Classification

antifungal agent An antimicrobial agent that destroys fungi by suppressing their ability to grow or reproduce.

bacterial metabolite Any prokaryotic metabolite produced during a metabolic reaction in bacteria.

antimicrobial agent A substance that kills or slows the growth of microorganisms, including bacteria, viruses, fungi and protozoans.

ChEBI Ontology

Outgoing Relation(s)
	pradimicin B (CHEBI:8350) has functional parent D-alanine (CHEBI:15570)
	pradimicin B (CHEBI:8350) is a L-alanine derivative (CHEBI:83943)
	pradimicin B (CHEBI:8350) is a aromatic ether (CHEBI:35618)
	pradimicin B (CHEBI:8350) is a monosaccharide derivative (CHEBI:63367)
	pradimicin B (CHEBI:8350) is a polyketide (CHEBI:26188)
	pradimicin B (CHEBI:8350) is a polyphenol (CHEBI:26195)
	pradimicin B (CHEBI:8350) is a pradimicin (CHEBI:83230)
	pradimicin B (CHEBI:8350) is a secondary alcohol (CHEBI:35681)

IUPAC Name
(2R)-2-({[(5S,6S)-5-{[(2S,3R,4S,5R,6R)-3,4-dihydroxy-6-methyl-5-(methylamino)tetrahydro-2H-pyran-2-yl]oxy}-1,6,9,14-tetrahydroxy-11-methoxy-3-methyl-8,13-dioxo-5,6,8,13-tetrahydrobenzo[a]tetracen-2-yl]carbonyl}amino)propanoic acid

Manual Xrefs	Databases
C06783	KEGG COMPOUND

Citations