input word = C00039299

Metabolite InformationStructural formula
Name Guai-6-ene
Formula C17H28O4
Mw 296.19875938
CAS RN 20071-71-0
C_ID C00039299 ,
InChIKey REJCNTXYQCAGNA-UHFFFAOYNA-N
InChICode InChI=1S/C17H28O4/c1-9(2)14-13(19)8-10(3)12-6-7-17(5,20)15(12)16(14)21-11(4)18/h9,13-16,19-20H,6-8H2,1-5H3/t13-,14-,15+,16-,17+/m0/s1
SMILES [C@@H]1([C@H]([C@H](CC(=C2[C@H]1[C@](CC2)(C)O)C)O)C(C)C)OC(=O)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeMelastomataceaeAcanthella cavernosa Dendy Ref.
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OrganismAcanthella cavernosa Dendy
ReferenceJumaryatno,J.Nat.Prod.,70,(2007),1725