input word = C00022226

Metabolite InformationStructural formula
Name Henrilabdane A
(-)-Henrilabdane A
Formula C20H32O4
Mw 336.23005951
CAS RN 126221-41-8
C_ID C00022226 ,
InChIKey PZEKZRHZHHZLOB-INOBHUJWNA-N
InChICode InChI=1S/C20H32O4/c1-13-6-7-17-19(3,9-5-10-20(17,4)18(23)24)15(13)12-16(22)14(2)8-11-21/h8,15-17,21-22H,1,5-7,9-12H2,2-4H3,(H,23,24)/b14-8+/t15-,16-,17-,19+,20-/m0/s1
SMILES C=C1CCC2[C@](C)(CCC[C@]2(C)C(=O)O)[C@H]1C[C@H](O)/C(C)=C/CO
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeChloranthaceaeChloranthus henryi Ref.
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OrganismChloranthus henryi
ReferenceLi,Phytochem.,69,(2008),2867