input word = C00048625

Metabolite InformationStructural formula
Name Axiplyn E
Formula C16H25NO3S
Mw 311.1555144
CAS RN 1021428-12-5
C_ID C00048625 ,
InChIKey APGMRVREUPWQPH-ISHYLPHTNA-N
InChICode InChI=1S/C16H25NO3S/c1-9(2)10-5-6-14(3,17-8-21)12-7-11-13(18)16(10,12)20-15(11,4)19/h9-13,18-19H,5-7H2,1-4H3/t10-,11+,12-,13+,14-,15+,16-/m0/s1
SMILES [C@@]123[C@H]([C@@](CC[C@H]1C(C)C)(C)N=C=S)C[C@@H]([C@@](O2)(O)C)[C@H]3O
Start Substs in Alk. Biosynthesis (Prediction) L-Arg
Organism
Kingdom Family Species Reference
AnimaliaDemospongiaeAxinyssa aplysinoides Ref.
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OrganismAxinyssa aplysinoides
ReferenceBlunt,Nat.Prod.Rep.,27,(2010),165