input word = C00036787

Metabolite InformationStructural formula
Name Auxemim
(+)-Auxemim
Formula C18H20O5
Mw 316.13107375
CAS RN 327993-81-7
C_ID C00036787 ,
InChIKey YUSQMBTTXHDJRO-JVQXHTGUNA-N
InChICode InChI=1S/C18H20O5/c1-18-8-11-10(13(19)7-14(21-2)16(11)20)6-12(18)9-4-5-15(18)23-17(9)22-3/h6-7,9,15,17H,4-5,8H2,1-3H3/t9-,15+,17-,18-/m0/s1
SMILES C1(=CC(=O)C2=C(C1=O)C[C@]1(C(=C2)[C@H]2[C@H](O[C@@H]1CC2)OC)C)OC
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeBoraginaceaeAuxemma oncocalyx Ref.
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OrganismAuxemma oncocalyx
ReferenceMarques,Phytochem.,55,(2000),793