input word = C00053624

Metabolite InformationStructural formula
Name Palustral
8,13-Abietadien-18-al
Formula C20H30O
Mw 286.22966558
CAS RN 13508-03-7
C_ID C00053624
InChIKey MDWQSNIQXHNTCK-SLFFLAALSA-N
InChICode InChI=1S/C20H30O/c1-14(2)15-6-8-17-16(12-15)7-9-18-19(3,13-21)10-5-11-20(17,18)4/h12-14,18H,5-11H2,1-4H3/t18-,19-,20+/m0/s1
SMILES CC(C)C1=CC(CC[C@]2([H])[C@]3(C)CCC[C@@]2(C)C=O)=C3CC1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaePinaceaePinus koraiensis Ref.
PlantaePinaceaePinus sibirica Ref.
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OrganismPinus sibirica
ReferenceRogachev, A. D. et al., Chem. Biodiv., 12, (2015), 1-53.