input word = C00022474

Metabolite InformationStructural formula
Name 15-Acetoxy-8,13E-labdadien-7-one
Formula C22H34O3
Mw 346.25079495
CAS RN 130548-20-8
C_ID C00022474 ,
InChIKey TVBXJRSJFQRXOQ-CEBPALEQNA-N
InChICode InChI=1S/C22H34O3/c1-15(10-13-25-17(3)23)8-9-18-16(2)19(24)14-20-21(4,5)11-7-12-22(18,20)6/h10,20H,7-9,11-14H2,1-6H3/b15-10+/t20-,22+/m0/s1
SMILES C1CC([C@H]2[C@](C1)(C(=C(C(=O)C2)C)CC/C(=C/COC(=O)C)/C)C)(C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeOrobanchaceaeParentucellia latifolia Ref.
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