input word = C00038550

Metabolite InformationStructural formula
Name Axinisothiocyanate C
(+)-Axinisothiocyanate C
Formula C16H25NO2S
Mw 295.16059978
CAS RN 1015475-76-9
C_ID C00038550 ,
InChIKey KMKVJTMIHMKYBS-NKSMTTDVNA-N
InChICode InChI=1S/C16H25NO2S/c1-10(2)11-5-7-15(3,17-9-20)12-6-8-16(4,19)14(18)13(11)12/h10,12,14,18-19H,5-8H2,1-4H3/t12-,14+,15-,16-/m1/s1
SMILES [C@]1(CC[C@@H]2C(=C(CC[C@@]2(C)N=C=S)C(C)C)[C@@H]1O)(C)O
Start Substs in Alk. Biosynthesis (Prediction) L-Pro L-Arg
Organism
Kingdom Family Species Reference
AnimaliaDemospongiaeAxinyssa sp. Ref.
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