input word = C00003369

Metabolite InformationStructural formula
Name Stramonin B
Formula C15H18O4
Mw 262.12050906
CAS RN 65179-88-6
C_ID C00003369 ,
InChIKey AYSAVJUPCHRCGO-WCXKZTIVNA-N
InChICode InChI=1S/C15H18O4/c1-8-3-4-10-12(19-13(17)15(10)7-18-15)14(2)9(8)5-6-11(14)16/h5-6,8-10,12H,3-4,7H2,1-2H3/t8-,9+,10+,12+,14?,15-/m0/s1
SMILES [C@H]12[C@]([C@H]3[C@@H](CC[C@@H]1C)[C@@]1(C(=O)O3)OC1)(C(=O)C=C2)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeParthenium tomentosum var. stramonium Ref.
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