input word = C00002281

Metabolite InformationStructural formula
Name Brugine
Formula C12H19NO2S2
Mw 273.08572032
CAS RN 14912-30-2
C_ID C00002281 ,
InChIKey BOJOZZSCQUTEBY-IEEYNNDKNA-N
InChICode InChI=1S/C12H19NO2S2/c1-13-8-2-3-9(13)7-10(6-8)15-12(14)11-4-5-16-17-11/h8-11H,2-7H2,1H3/t8-,9+,10-,11-/m0/s1
SMILES N1([C@H]2C[C@H](C[C@@H]1CC2)OC(=O)[C@@H]1CCSS1)C
Start Substs in Alk. Biosynthesis (Prediction) L-Pro L-Lys L-Arg L-Ala L-Asp
Organism
Kingdom Family Species Reference
PlantaeRhizophoraceaeBruguiera exaristata Ref.
PlantaeRhizophoraceaeBruguiera sexangula Ref.
PlantaeRhizophoraceaeCrossostylis biflora Ref.
PlantaeRhizophoraceaeCrossostylis multiflora Ref.
PlantaeRhizophoraceaeCrossostylis sebertii Ref.
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OrganismBruguiera sexangula
ReferenceHarborne,Phytochemical Dictionary Second Edition,Taylor and Francis,(1999),Chapter30