input word = C00012058

Metabolite InformationStructural formula
Name (+)-20-Hydroxyelemajurinelloide
Formula C20H26O7
Mw 378.16785319
CAS RN 113412-04-7
C_ID C00012058 ,
InChIKey LLQFQSPYTBILCD-BUBSPENQNA-N
InChICode InChI=1S/C20H26O7/c1-5-13(9-22)19(25)26-14-7-20(6-2,10-23)16(11(3)8-21)17-15(14)12(4)18(24)27-17/h5-6,14-17,21-23H,2-4,7-10H2,1H3/b13-5-/t14-,15+,16+,17-,20+/m0/s1
SMILES C=C[C@]1(CO)C[C@H](OC(=O)/C(=CC)CO)[C@H]2C(=C)C(=O)O[C@@H]2[C@H]1C(=C)CO
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeJurinella moschus Ref.
zoom in