input word = C00022668

Metabolite InformationStructural formula
Name 5alpha-Hydroperoxycostic acid methyl ester
Formula C16H24O4
Mw 280.16745925
CAS RN 112823-81-1
C_ID C00022668 ,
InChIKey XSFRJTINOXLAHU-HLRBPWBTNA-N
InChICode InChI=1S/C16H24O4/c1-11-6-5-8-15(3)9-7-13(10-16(11,15)20-18)12(2)14(17)19-4/h13,18H,1-2,5-10H2,3-4H3/t13-,15?,16-/m1/s1
SMILES C1CC(=C)[C@]2([C@](C1)(CC[C@H](C2)C(=C)C(=O)OC)C)OO
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeEriocephalus pauperrimus Ref.
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