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CHEBI:209527 - Napyradiomycin A3

ChEBI IDCHEBI:209527
ChEBI NameNapyradiomycin A3
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC25H30O7
Net Charge0
Average Mass442.508
Monoisotopic Mass442.19915
SMILESC=C(C)C(O)CCC(C)=CC[C@@]12OC(C)(C)[C@@H](O)C=C1C(=O)c1c(O)cc(O)cc1C2=O
InChIInChI=1S/C25H30O7/c1-13(2)18(27)7-6-14(3)8-9-25-17(12-20(29)24(4,5)32-25)22(30)21-16(23(25)31)10-15(26)11-19(21)28/h8,10-12,18,20,26-29H,1,6-7,9H2,2-5H3/t18?,20-,25+/m0/s1
InChIKeyBPLKXUXDARUPCB-MNISZPLNSA-N
Species of MetaboliteComponentSourceComments
Streptomyces (ncbitaxon:1883) - PubMed (31888028)
Roles Classification
Biological Roles:
fat-soluble vitamin (role)  Any vitamin that dissolves in fats and are stored in body tissues. Unlike the water-soluble vitamins, they are stored in the body for long periods of time and generally pose a greater risk for toxicity when consumed in excess.
mouse metabolite  Any mammalian metabolite produced during a metabolic reaction in a mouse (Mus musculus).
ChEBI Ontology
Outgoing Relation(s)
Napyradiomycin A3 (CHEBI:209527) is a vitamin K (CHEBI:28384)
IUPAC Name 
(3S,10aR)-3,6,8-trihydroxy-10a-(6-hydroxy-3,7-dimethylocta-2,7-dienyl)-2,2-dimethyl-3H-benzo[g]chromene-5,10-dione