input word = C00020465

Metabolite InformationStructural formula
Name Diaspanoside C
Formula C21H30O9
Mw 426.18898256
CAS RN 109605-94-9
C_ID C00020465 ,
InChIKey WKZOZGLYJRRROY-GWFXIAQNNA-N
InChICode InChI=1S/C21H30O9/c1-8-4-5-10-9(2)19(26)30-18(10)14-11(8)6-13(21(14,3)27)29-20-17(25)16(24)15(23)12(7-22)28-20/h10-18,20,22-25,27H,1-2,4-7H2,3H3/t10-,11-,12+,13-,14-,15+,16-,17+,18-,20-,21+/m0/s1
SMILES [C@H]1([C@@]([C@H]2[C@@H](C1)C(=C)CC[C@@H]1[C@@H]2OC(=O)C1=C)(C)O)O[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeDiaspananthus uniflorus Ref.
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OrganismDiaspananthus uniflorus
ReferenceAdegawa,Chem. Pharm. Bull.,35,(1987),1479