input word = C00044424

Metabolite InformationStructural formula
Name 18-Acetoxy-cis-clerodan-3-ene-15-oic acid
(+)-18-Acetoxy-cis-clerodan-3-ene-15-oic acid
Formula C22H36O4
Mw 364.26135964
CAS RN 82178-19-6
C_ID C00044424 ,
InChIKey QSEIUMVWJJWZJP-WJICJXQUNA-N
InChICode InChI=1S/C22H36O4/c1-15(13-20(24)25)9-11-21(4)16(2)10-12-22(5)18(14-26-17(3)23)7-6-8-19(21)22/h7,15-16,19H,6,8-14H2,1-5H3,(H,24,25)/t15-,16+,19+,21-,22+/m0/s1
SMILES C1C=C([C@@]2([C@H](C1)[C@@]([C@@H](CC2)C)(C)CC[C@@H](CC(=O)O)C)C)COC(=O)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeCistaceaeCistus monspeliensis Ref.
zoom in