input word = C00048807

Metabolite InformationStructural formula
Name Pachychaline C
Formula C71H128N5
Mw 1051.01697412
CAS RN 1030879-60-7
C_ID C00048807 ,
InChIKey GGYOTPDKMLXFLP-UHFFFAOYSA-N
InChICode InChI=1S/C71H128N5/c72-58-44-36-28-20-12-5-1-3-7-14-22-30-38-46-60-74-63-49-55-69(66-74)52-41-33-25-17-9-10-18-26-34-42-53-70-56-50-65-76(67-70)62-48-40-32-24-16-11-19-27-35-43-54-71-57-51-64-75(68-71)61-47-39-31-23-15-8-4-2-6-13-21-29-37-45-59-73/h49-51,55-57,63-68H,1-48,52-54,58-62,72-73H2
SMILES c1(CCCCCCCCCCCCc2cn(ccc2)CCCCCCCCCCCCc2cccn(c2)CCCCCCCCCCCCCCCCN)cccn(c1)CCCCCCCCCCCCCCCCN
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
--Pachychalina sp. Ref.
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