input word = C00040699

Metabolite InformationStructural formula
Name Xestoquinone
Formula C20H14O4
Mw 318.08920894
CAS RN 97743-96-9
C_ID C00040699 ,
InChIKey HDONDRKCXFRHQQ-GNLPSFAGNA-N
InChICode InChI=1S/C20H14O4/c1-20-6-2-3-10-9-24-19(17(10)20)18(23)13-7-11-12(8-14(13)20)16(22)5-4-15(11)21/h4-5,7-9H,2-3,6H2,1H3/t20-/m0/s1
SMILES C1=CC(=O)c2c(C1=O)cc1c(c2)C(=O)c2c3[C@]1(CCCc3co2)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
AnimaliaPetrosiidaeXestospongia cf. carbonaria Ref.
AnimaliaPetrosiidaeXestospongia sapra Ref.
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OrganismXestospongia sapra
ReferenceNakao,J.Nat.Prod.,70,(2007),689