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CHEBI:203179 - Pluraflavin B

ChEBI IDCHEBI:203179
ChEBI NamePluraflavin B
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC43H56N2O15
Net Charge0
Average Mass840.920
Monoisotopic Mass840.36807
SMILESCC1OC(OCc2cc3c(c4oc(C(C)(O)C(C)O)cc(=O)c24)C(=O)c2c(ccc([C@H]4C[C@H](N(C)C)[C@H](O[C@H]5C[C@H](O)[C@H](O)[C@H](C)O5)[C@H](C)O4)c2O)C3=O)CC(C)(N)C1O
InChIInChI=1S/C43H56N2O15/c1-17-35(49)27(48)14-30(57-17)60-39-18(2)56-28(12-25(39)45(7)8)22-9-10-23-33(37(22)51)38(52)34-24(36(23)50)11-21(16-55-31-15-42(5,44)41(53)19(3)58-31)32-26(47)13-29(59-40(32)34)43(6,54)20(4)46/h9-11,13,17-20,25,27-28,30-31,35,39,41,46,48-49,51,53-54H,12,14-16,44H2,1-8H3/t17-,18-,19?,20?,25-,27-,28+,30-,31?,35+,39+,41?,42?,43?/m0/s1
InChIKeyNXVFOCZKPDWDTH-IXTMJGLFSA-N
Species of MetaboliteComponentSourceComments
Saccharothrix (ncbitaxon:2071) - PubMed (11714228)
ChEBI Ontology
Outgoing Relation(s)
Pluraflavin B (CHEBI:203179) is a benzochromenone (CHEBI:64986)
Pluraflavin B (CHEBI:203179) is a glycoside (CHEBI:24400)
IUPAC Name 
5-[(4-amino-5-hydroxy-4,6-dimethyloxan-2-yl)oxymethyl]-2-(2,3-dihydroxybutan-2-yl)-10-[(2R,4S,5S,6S)-5-[(2S,4S,5S,6S)-4,5-dihydroxy-6-methyloxan-2-yl]oxy-4-(dimethylamino)-6-methyloxan-2-yl]-11-hydroxynaphtho[2,3-h]chromene-4,7,12-trione
Manual XrefsDatabases
78445108ChemSpider