input word = C00038555

Metabolite InformationStructural formula
Name Axinisothiocyanate H
(+)-Axinisothiocyanate H
Formula C17H25NO3S
Mw 323.1555144
CAS RN 1015475-82-7
C_ID C00038555 ,
InChIKey YRDIFUBGWKWYME-LGLOVAMMNA-N
InChICode InChI=1S/C17H25NO3S/c1-11(2)17(14(19)20)8-7-16(4,18-10-22)12-5-6-15(3,21)9-13(12)17/h9,11-12,21H,5-8H2,1-4H3,(H,19,20)/t12-,15-,16+,17+/m1/s1
SMILES [C@]1(CC[C@@H]2C(=C1)[C@](CC[C@]2(C)N=C=S)(C(C)C)C(=O)O)(C)O
Start Substs in Alk. Biosynthesis (Prediction) L-Arg
Organism
Kingdom Family Species Reference
AnimaliaDemospongiaeAxinyssa sp. Ref.
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