input word = C00042880

Metabolite InformationStructural formula
Name Pulicanadienal B
(+)-Pulicanadienal B
Formula C17H26O4
Mw 294.18310932
CAS RN 851595-73-8
C_ID C00042880 ,
InChIKey LJPDGWZMSFNUPH-SRSHAXBCNA-N
InChICode InChI=1S/C17H26O4/c1-12(2)15-7-9-17(4,20)8-5-6-14(11-18)10-16(15)21-13(3)19/h6-7,9,11-12,15-16,20H,5,8,10H2,1-4H3/b9-7+,14-6+/t15-,16+,17+/m0/s1
SMILES C1C/C=C(\C[C@H]([C@@H](/C=C/[C@]1(C)O)C(C)C)OC(=O)C)/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