input word = C00021448

Metabolite InformationStructural formula
Name Ptaquiloside
Braxin C
Formula C20H30O8
Mw 398.19406794
CAS RN 87625-62-5
C_ID C00021448 ,
InChIKey GPHSJPVUEZFIDE-OBJSXLPANA-N
InChICode InChI=1S/C20H30O8/c1-9-6-20(28-17-15(25)14(24)13(23)11(8-21)27-17)7-10(2)19(4-5-19)18(3,26)16(20)12(9)22/h7,9,11,13-17,21,23-26H,4-6,8H2,1-3H3/t9-,11-,13-,14+,15-,16-,17+,18+,20+/m1/s1
SMILES CC1=C[C@]2(O[C@@H]3OC(CO)[C@@H](O)[C@H](O)C3O)C[C@@H](C)C(=O)[C@@H]2[C@](C)(O)C12CC2
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeCbotiaceae/DicksoniaceaeCibotium borometz Ref.
PlantaeDennstaedtiaceaeDennstaedtia scabra Ref.
PlantaeDennstaedtiaceaeHistiopteris incisa Ref.
PlantaeDennstaedtiaceaeHypolepis punctata Ref.
PlantaeDennstaedtiaceaeMicrolepia strigosa Ref.
PlantaeDennstaedtiaceaePteridium aquilinum Ref.
PlantaeMonachosoraceaeMonachosorum flagellare Ref.
PlantaePteridaceaePteris cretica Ref.
zoom in