input word = C00042885

Metabolite InformationStructural formula
Name Pulicanaral A
(+)-Pulicanaral A
Formula C19H28O6
Mw 352.18858863
CAS RN 851595-69-2
C_ID C00042885 ,
InChIKey VSTUOYUGFWGERJ-YNIINQCLNA-N
InChICode InChI=1S/C19H28O6/c1-11(2)18-15(23-13(4)21)8-12(3)6-7-17-19(10-20,25-17)9-16(18)24-14(5)22/h8,10-11,15-18H,6-7,9H2,1-5H3/b12-8-/t15-,16-,17-,18-,19-/m1/s1
SMILES [C@]12([C@@H](CC/C(=C\[C@H]([C@H]([C@@H](C1)OC(=O)C)C(C)C)OC(=O)C)/C)O2)C=O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaePulicaria canariensis Ref.
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OrganismPulicaria canariensis
ReferenceTriana,J.Nat.Prod.,68,(2005),523