input word = C00003209

Metabolite InformationStructural formula
Name Amaralin
Formula C15H20O4
Mw 264.13615913
CAS RN 6831-10-3
C_ID C00003209 ,
InChIKey XPNBRTWIMIGGMT-BJAHRNFLNA-N
InChICode InChI=1S/C15H20O4/c1-6-4-9-8(7(2)14(17)18-9)5-15(3)10(6)11-12(19-11)13(15)16/h6,8-13,16H,2,4-5H2,1,3H3/t6-,8-,9+,10-,11-,12-,13+,15+/m1/s1
SMILES [C@@H]12[C@](C[C@H]3[C@H](C[C@H]1C)OC(=O)C3=C)([C@H]([C@H]1[C@@H]2O1)O)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeHelenium amarum Ref.
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