input word = C00006268

Metabolite InformationStructural formula
Name Spinosin
Formula C28H32O15
Mw 608.17412036
CAS RN 72063-39-9
C_ID C00006268 ,
InChIKey VGGSULWDCMWZPO-LRIMOGAENA-N
InChICode InChI=1S/C28H32O15/c1-39-14-7-15-18(12(32)6-13(40-15)10-2-4-11(31)5-3-10)22(35)19(14)26-27(24(37)21(34)16(8-29)41-26)43-28-25(38)23(36)20(33)17(9-30)42-28/h2-7,16-17,20-21,23-31,33-38H,8-9H2,1H3/t16-,17-,20-,21-,23+,24+,25-,26+,27-,28+/m1/s1
SMILES c1(c(c(c2c(c1)oc(cc2=O)c1ccc(cc1)O)O)[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O)OC
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeEuphorbiaceaeClutia abyssinica Ref.
PlantaeEuphorbiaceaeStrophioblachia fimbricalyx Boerl Ref.
PlantaeGentianaceaeSwertia spp. Ref.
PlantaeIridaceaeIris nertshinskia Ref.
PlantaeRhamnaceaeZiziphus jujuba Ref.
PlantaeRhamnaceaeZiziphus jujuba var.spinosa Ref.
PlantaeRhamnaceaeZiziphus spp. Ref.
zoom in