input word = C00033065

Metabolite InformationStructural formula
Name alpha-Pinacene
Isoneocembrene A
Formula C20H32
Mw 272.25040102
CAS RN 64363-64-0
C_ID C00033065 ,
InChIKey UJUWZMUCEGGBOH-YBJPMODXSA-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\1(=C/CC/C(=C/C=C(\CC/C(=C/CC1)/C)/C(C)C)/C)/C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeOrchidaceaeSarcophyton trocheliophorum Ref.
PlantaePinaceaePinus sibirica Ref.
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OrganismSarcophyton trocheliophorum
ReferenceDong,Chem.Pharm.Bull.,48,(2000),1087