input word = C00023447

Metabolite InformationStructural formula
Name Relhaniaic acid
Formula C20H30O3
Mw 318.21949482
CAS RN 72023-10-0
C_ID C00023447 ,
InChIKey WLZMZARRLMIMRW-NQSHOZANNA-N
InChICode InChI=1S/C20H30O3/c1-13(10-18(22)23)8-9-20(5)14(2)6-7-16-17(20)11-15(21)12-19(16,3)4/h10-11,14,16H,6-9,12H2,1-5H3,(H,22,23)/b13-10+/t14-,16-,20-/m1/s1
SMILES C1(=O)CC([C@H]2C(=C1)[C@@]([C@@H](CC2)C)(CC/C(=C/C(=O)O)/C)C)(C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeRelhania acerosa Ref.
zoom in