input word = C00020763

Metabolite InformationStructural formula
Name Diaspanoside A
Formula C21H28O9
Mw 424.17333249
CAS RN 109668-73-7
C_ID C00020763 ,
InChIKey ARJUJAMZTUUZNZ-HJHIPYPGNA-N
InChICode InChI=1S/C21H28O9/c1-7-10-5-13(28-21-18(26)17(25)16(24)14(6-22)29-21)9(3)15(10)19-11(4-12(7)23)8(2)20(27)30-19/h10-19,21-26H,1-6H2/t10-,11-,12-,13-,14+,15-,16+,17-,18+,19-,21+/m0/s1
SMILES C=C1[C@@H]2[C@H]3OC(=O)C(=C)[C@@H]3C[C@H](O)C(=C)[C@@H]2C[C@@H]1O[C@@H]1OC(CO)[C@@H](O)[C@H](O)C1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeCrepis pulchra L. Ref.
PlantaeAsteraceaeDiaspananthus uniflorus Ref.
zoom in