input word = C00020532

Metabolite InformationStructural formula
Name Crepidiaside C
Formula C21H30O9
Mw 426.18898256
CAS RN 101921-37-3
C_ID C00020532 ,
InChIKey FNHCEZDZQTYVET-BQHOLGCYNA-N
InChICode InChI=1S/C21H30O9/c1-8-5-12(23)14-9(2)20(27)30-19(14)15-10(3-4-11(8)15)7-28-21-18(26)17(25)16(24)13(6-22)29-21/h3,9,12-19,21-26H,4-7H2,1-2H3/t9-,12+,13-,14-,15+,16-,17+,18-,19+,21-/m1/s1
SMILES CC1=C2CC=C(CO[C@@H]3OC(CO)[C@@H](O)[C@H](O)C3O)[C@@H]2[C@H]2OC(=O)C(C)[C@@H]2[C@@H](O)C1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeCichorium pumilum Ref.
PlantaeAsteraceaeCrepidiastrum keiskeanum Ref.
PlantaeAsteraceaeYoungia koidzumiana Kitam. Ref.
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