input word = C00001296

Metabolite InformationStructural formula
Name Thiarubrine B
Formula C13H8S2
Mw 228.00674172
CAS RN 71539-72-5
C_ID C00001296 ,
InChIKey BXWWIWROJFOGMW-UHFFFAOYSA-N
InChICode InChI=1S/C13H8S2/c1-3-5-7-9-13-11-10-12(14-15-13)8-6-4-2/h4,10-11H,2H2,1H3
SMILES C=CC#CC1=CC=C(C#CC#CC)SS1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeChaenactis douglasii Ref.
zoom in



OrganismChaenactis douglasii
ReferenceHarborne,Phytochemical Dictionary Second Edition,Taylor and Francis,(1999),Chapter8