input word = C00028189

Metabolite InformationStructural formula
Name Digonazole
Formula C34H58N2O7
Mw 606.42440222
CAS RN 157536-06-6
C_ID C00028189 ,
InChIKey UTUBLIPCJHOMFB-UHFFFAOYNA-N
InChICode InChI=1S/C34H58N2O7/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-33(39)43-31(23-30(38)34(40)27(2)37)29-25-41-32(36-29)22-28-24-35-26-42-28/h24-27,30-31,34,37-38,40H,3-23H2,1-2H3/t27-,30+,31-,34-/m0/s1
SMILES c1(coc(n1)Cc1cnco1)[C@@H](OC(=O)CCCCCCCCCCCCCCCCCCCC)C[C@H]([C@H]([C@H](C)O)O)O
Start Substs in Alk. Biosynthesis (Prediction) L-Lys L-Asp
Organism
Kingdom Family Species Reference
--Jaspis digonexea Ref.
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