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CHEBI:204196 - FD-891

ChEBI IDCHEBI:204196
ChEBI NameFD-891
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SubmitterMetaboLights
DownloadsMolfile
FormulaC33H54O8
Net Charge0
Average Mass578.787
Monoisotopic Mass578.38187
SMILESCOC(C)C(C)C(O)C(C)C(O)CC[C@H](C)[C@@H]1C/C=C/C=C/C[C@@H](O)[C@H]2O[C@@H]2[C@H](O)[C@H](C)/C=C(C)/C=C(\C)C(=O)O1
InChIInChI=1S/C33H54O8/c1-19-17-21(3)29(36)32-31(41-32)27(35)13-11-9-10-12-14-28(40-33(38)22(4)18-19)20(2)15-16-26(34)24(6)30(37)23(5)25(7)39-8/h9-12,17-18,20-21,23-32,34-37H,13-16H2,1-8H3/b11-9+,12-10+,19-17+,22-18+/t20-,21+,23?,24?,25?,26?,27+,28-,29+,30?,31+,32+/m0/s1
InChIKeyVOLRALTUADVHPT-VVTOKWSESA-N
Species of MetaboliteComponentSourceComments
Streptomyces (ncbitaxon:1883) - PubMed (8002384)
ChEBI Ontology
Outgoing Relation(s)
FD-891 (CHEBI:204196) is a macrolide (CHEBI:25106)
IUPAC Name 
(1R,2R,3R,4E,6E,10S,12E,14E,17R,18R)-10-[(2S)-5,7-dihydroxy-9-methoxy-6,8-dimethyldecan-2-yl]-2,17-dihydroxy-3,5,7-trimethyl-9,19-dioxabicyclo[16.1.0]nonadeca-4,6,12,14-tetraen-8-one
Manual XrefsDatabases
8206677ChemSpider