input word = C00022241

Metabolite InformationStructural formula
Name (8alpha,13E)-8,15-Dihydroxy-13-labden-19-al
Formula C20H34O3
Mw 322.25079495
CAS RN 117232-45-8
C_ID C00022241 ,
InChIKey CQAZVEHOHSEEFJ-TVILTKGXNA-N
InChICode InChI=1S/C20H34O3/c1-15(9-13-21)6-7-17-19(3)11-5-10-18(2,14-22)16(19)8-12-20(17,4)23/h9,14,16-17,21,23H,5-8,10-13H2,1-4H3/b15-9+/t16-,17+,18+,19-,20+/m0/s1
SMILES C/C(=CCO)CC[C@@H]1[C@@]2(C)CCC[C@](C)(C=O)C2CC[C@@]1(C)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeCupressaceaeJuniperus thurifera Ref.
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