input word = C00017279

Metabolite InformationStructural formula
Name Sphingofungin D
Formula C22H41NO7
Mw 431.28830267
CAS RN 121025-47-6
C_ID C00017279 ,
InChIKey VKFZVQCKAPPEFZ-XVAIPPAMNA-N
InChICode InChI=1S/C22H41NO7/c1-3-4-5-10-13-17(25)14-11-8-6-7-9-12-15-18(26)20(27)21(28)19(22(29)30)23-16(2)24/h12,15,17-21,25-28H,3-11,13-14H2,1-2H3,(H,23,24)(H,29,30)/b15-12+/t17-,18-,19-,20+,21+/m0/s1
SMILES C(CC[C@@H](CCCCCC/C=C/[C@@H]([C@H]([C@@H]([C@@H](C(=O)O)NC(=O)C)O)O)O)O)CCC
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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OrganismAspergillus fumigatus ATCC 20857
ReferenceVanmiddlesworth,J.Antibiotics 45,(1992),861