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CHEBI:226528 - FD-895

ChEBI IDCHEBI:226528
ChEBI NameFD-895
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SubmitterMetaboLights
DownloadsMolfile
FormulaC31H50O9
Net Charge0
Average Mass566.732
Monoisotopic Mass566.34548
SMILESCCC(OC)C(C)C1OC1C(O)C(C)/C=C/C=C(\C)C1OC(=O)CC(O)CCC(C)(O)C(OC(C)=O)/C=C/C1C
InChIInChI=1S/C31H50O9/c1-9-24(37-8)21(5)29-30(40-29)27(35)18(2)11-10-12-19(3)28-20(4)13-14-25(38-22(6)32)31(7,36)16-15-23(33)17-26(34)39-28/h10-14,18,20-21,23-25,27-30,33,35-36H,9,15-17H2,1-8H3/b11-10+,14-13+,19-12+
InChIKeyLDCZLUDGHYDTHV-FPZDJJGISA-N
Species of MetaboliteComponentSourceComments
Streptomyces (ncbitaxon:1883) - PubMed (7844034)
ChEBI Ontology
Outgoing Relation(s)
FD-895 (CHEBI:226528) is a diterpene lactone (CHEBI:49193)
IUPAC Name 
[(4E)-7,10-dihydroxy-2-[(2E,4E)-7-hydroxy-7-[3-(3-methoxypentan-2-yl)oxiran-2-yl]-6-methylhepta-2,4-dien-2-yl]-3,7-dimethyl-12-oxo-1-oxacyclododec-4-en-6-yl] acetate
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