input word = C00044128

Metabolite InformationStructural formula
Name Cnidiadin
Formula C18H20O5
Mw 316.13107375
CAS RN 41137-88-6
C_ID C00044128 ,
InChIKey JBQHVGSHZLWWDC-YQTOOIBONA-N
InChICode InChI=1S/C18H20O5/c1-10(2)17(20)23-18(3,4)14-9-12-13(21-14)7-5-11-6-8-15(19)22-16(11)12/h5-8,10,14H,9H2,1-4H3/t14-/m0/s1
SMILES CC(C)C(=O)OC(C)(C)[C@@H]1Cc2c(ccc3ccc(=O)oc23)O1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeApiaceaeTordylium apulum Ref.
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