input word = C00020892

Metabolite InformationStructural formula
Name Carolenalin
Formula C15H22O4
Mw 266.15180919
CAS RN 38769-25-4
C_ID C00020892 ,
InChIKey XXFLOPBDRWUQBW-WKCNYLJPNA-N
InChICode InChI=1S/C15H22O4/c1-7-4-12-10(8(2)14(17)19-12)5-11-9(7)6-13(16)15(11,3)18/h4,8-13,16,18H,5-6H2,1-3H3/t8-,9-,10+,11+,12-,13+,15-/m0/s1
SMILES [C@@H]12[C@@H](C[C@H]3[C@H](C=C1C)OC(=O)[C@H]3C)[C@]([C@@H](C2)O)(C)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeHelenium autumnale Ref.
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