input word = C00017276

Metabolite InformationStructural formula
Name Sphingofungin A
Formula C21H41N3O6
Mw 431.29953606
CAS RN 121025-44-3
C_ID C00017276 ,
InChIKey FFZVMOYYSHXZHW-OLVRQTJPNA-N
InChICode InChI=1S/C21H41N3O6/c1-2-3-4-9-12-15(25)13-10-7-5-6-8-11-14-16(26)18(27)19(28)17(20(29)30)24-21(22)23/h11,14-19,25-28H,2-10,12-13H2,1H3,(H,29,30)(H4,22,23,24)/b14-11+/t15-,16-,17-,18+,19+/m0/s1
SMILES CCCCCC[C@H](O)CCCCCC/C=C/[C@H](O)[C@@H](O)[C@H](O)[C@H](NC(=N)N)C(=O)O
Start Substs in Alk. Biosynthesis (Prediction) L-Pro L-Lys L-Arg L-Ala
Organism
Kingdom Family Species Reference
FungiTrichocomaceaeAspergillus fumigatus ATCC 20857 Ref.
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