CHEBI:207139 - 31-Homorifamycin W

ChEBI IDCHEBI:207139
ChEBI Name31-Homorifamycin W
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC36H47NO11
Net Charge0
Average Mass669.768
Monoisotopic Mass669.31491
SMILESCCC1/C=C\C=C(\C)C(=O)NC2=CC(=O)c3c(c(O)c(C)c(O)c3C(=O)/C(C)=C\C(CO)C(O)C(C)C(O)C(C)C(O)C(C)C1O)C2=O
InChIInChI=1S/C36H47NO11/c1-8-21-11-9-10-15(2)36(48)37-23-13-24(39)25-26(33(45)20(7)34(46)27(25)35(23)47)28(40)16(3)12-22(14-38)32(44)19(6)30(42)17(4)29(41)18(5)31(21)43/h9-13,17-19,21-22,29-32,38,41-46H,8,14H2,1-7H3,(H,37,48)/b11-9-,15-10-,16-12-
InChIKeyUYPVSSHIUNIPSJ-PTJIYHIGSA-N
Species of MetaboliteComponentSourceComments
Amycolatopsis (ncbitaxon:1813) - PubMed (8040064)
ChEBI Ontology
Outgoing Relation(s)
31-Homorifamycin W (CHEBI:207139) is a azamacrocycle (CHEBI:52898)
31-Homorifamycin W (CHEBI:207139) is a keratan 6'-sulfate (CHEBI:18331)
IUPAC Name 
(7Z,18Z,20Z)-17-ethyl-2,4,10,12,14,16-hexahydroxy-9-(hydroxymethyl)-3,7,11,13,15,21-hexamethyl-23-azatricyclo[22.3.1.05,27]octacosa-1,3,5(27),7,18,20,24-heptaene-6,22,26,28-tetrone
Manual XrefsDatabases
78444255ChemSpider