input word = C00052879

Metabolite InformationStructural formula
Name beta-Pinacene
Formula C20H32
Mw 272.25040102
CAS RN 37905-10-5
C_ID C00052879
InChIKey UJUWZMUCEGGBOH-HAYRGAEJSA-N
InChICode InChI=1S/C20H32/c1-16(2)20-14-12-18(4)10-6-8-17(3)9-7-11-19(5)13-15-20/h8,11-12,14,16H,6-7,9-10,13,15H2,1-5H3/b17-8+,18-12-,19-11+,20-14-
SMILES C/C1=C/C=C(C(C)C)CC/C(C)=C/CC/C(C)=C/CC1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaePinaceaePinus koraiensis Ref.
PlantaePinaceaePinus sibirica Ref.
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OrganismPinus koraiensis
ReferenceRaldugin, V.A. et al., Khim. Prir. Soedin., 1971, 7, 604

Chem. Nat. Compd. (Engl. Transl.), 582 (isol, ir, pmr)