input word = C00021665

Metabolite InformationStructural formula
Name 10-Isothiocyanato-4-cadinene
Formula C16H25NS
Mw 263.17077053
CAS RN 286465-89-2
C_ID C00021665 ,
InChIKey SRYJMNDTUAKSRD-ZXDCDXDMNA-N
InChICode InChI=1S/C16H25NS/c1-11(2)13-7-8-16(4,17-10-18)15-6-5-12(3)9-14(13)15/h9,11,13-15H,5-8H2,1-4H3/t13-,14+,15+,16+/m0/s1
SMILES C1C(=C[C@H]2[C@@H](C1)[C@](CC[C@H]2C(C)C)(C)N=C=S)C
Start Substs in Alk. Biosynthesis (Prediction) L-Pro L-Arg
Organism
Kingdom Family Species Reference
PlantaeMelastomataceaeAcanthella cavernosa Ref.
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