input word = C00021153

Metabolite InformationStructural formula
Name Florigrandin
Formula C20H30O7
Mw 382.19915331
CAS RN 51292-61-6
C_ID C00021153 ,
InChIKey SMAJXKLVHWNBRU-RTFITUPDNA-N
InChICode InChI=1S/C20H30O7/c1-5-10(2)17(23)26-14-7-15(22)19(4)8-12-13(6-11(3)16(14)19)27-18(24)20(12,25)9-21/h10-14,16,21,25H,5-9H2,1-4H3/t10-,11-,12+,13-,14+,16-,19-,20+/m1/s1
SMILES [C@@H]12[C@](C[C@H]3[C@@H](C[C@H]1C)OC(=O)[C@@]3(CO)O)(C(=O)C[C@@H]2OC(=O)[C@@H](CC)C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeHymenoxys grandiflora Ref.
zoom in