input word = C00048624

Metabolite InformationStructural formula
Name Axiplyn D
Formula C16H25NO3S
Mw 311.1555144
CAS RN 1021428-11-4
C_ID C00048624 ,
InChIKey CZXKCKSITMMTPE-VBUKMEGVNA-N
InChICode InChI=1S/C16H25NO3S/c1-9(2)12-5-6-15(4,17-8-21)13-7-11(10(3)18)14(19)16(12,13)20/h9,11-14,19-20H,5-7H2,1-4H3/t11-,12-,13-,14+,15-,16-/m0/s1
SMILES C1C[C@]([C@H]2[C@@]([C@@H]1C(C)C)([C@@H]([C@@H](C2)C(=O)C)O)O)(C)N=C=S
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