input word = C00055002

Metabolite InformationStructural formula
Name Cichoralexin
Formula C15H20O3
Mw 248.1412445
CAS RN 132296-37-8
C_ID C00055002
InChIKey FJKWKEZAHVWIOR-HKKIIAMESA-N
InChICode InChI=1S/C15H20O3/c1-7-4-5-10-9(3)15(17)18-14(10)13-8(2)6-11(16)12(7)13/h6-7,9-10,12-14H,4-5H2,1-3H3/t7-,9-,10-,12-,13-,14-/m0/s1
SMILES CC1=CC(=O)[C@H]2[C@H]1[C@H]1OC(=O)[C@@H](C)[C@@H]1CC[C@@H]2C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
BacteriaPseudomonadaceaePseudomonas cichorii Ref.
PlantaeAsteraceaeCichorium intybus Ref.
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