input word = C00001295

Metabolite InformationStructural formula
Name Thiarubrine A
Formula C13H8S2
Mw 228.00674172
CAS RN 63543-09-9
C_ID C00001295 ,
InChIKey XZHCLKKXXPKULI-UHFFFAOYSA-N
InChICode InChI=1S/C13H8S2/c1-3-5-6-7-9-13-11-10-12(8-4-2)14-15-13/h3,10-11H,1H2,2H3
SMILES C(
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
BacteriaRhizobiaceaeAgrobacterium rhizogenes Ref.
PlantaeAsteraceaeAspilia spp. Ref.
PlantaeAsteraceaeChaenactis douglasii Ref.
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OrganismChaenactis douglasii
ReferenceHarborne,Phytochemical Dictionary Second Edition,Taylor and Francis,(1999),Chapter8