input word = C00042700

Metabolite InformationStructural formula
Name Limnophilaspiroketone
Formula C18H16O9
Mw 376.07943211
CAS RN 862884-25-1
C_ID C00042700 ,
InChIKey PDQUFOPZEHNTQQ-KXBAJZQQNA-N
InChICode InChI=1S/C18H16O9/c1-24-13-14(21)18(17(23,15(13)25-2)16(22)26-3)12(20)8-11(27-18)9-4-6-10(19)7-5-9/h4-8,19,23H,1-3H3/t17-,18-/m0/s1
SMILES C1(=C(C(=O)[C@]2([C@]1(C(=O)OC)O)C(=O)C=C(O2)c1ccc(cc1)O)OC)OC
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaePlantaginaceaeLimnophila geoffroyi Ref.
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OrganismLimnophila geoffroyi
ReferenceJang,J.Nat.Prod.,68,(2005),1134