input word = C00028664

Metabolite InformationStructural formula
Name Neofolitispate 1
Formula C40H67N3O6
Mw 685.50298689
CAS RN 229160-50-3
C_ID C00028664 ,
InChIKey GHEDSWXRAIDICK-SXRVDWBNNA-N
InChICode InChI=1S/C40H67N3O6/c1-4-33-23-18-19-27-39(49-33)30-32-25-26-34-36(40(28-21-22-31(2)48-40)42-38(41-39)43(32)34)37(45)47-29-20-16-14-12-10-8-6-5-7-9-11-13-15-17-24-35(44)46-3/h18,23,31-34,36H,4-17,19-22,24-30H2,1-3H3,(H,41,42)/t31-,32+,33+,34-,36-,39+,40-/m1/s1
SMILES C1[C@H]2N3C(=N[C@]4([C@H]([C@H]3CC2)C(=O)OCCCCCCCCCCCCCCCCC(=O)OC)CCC[C@H](O4)C)N[C@]21O[C@H](C=CCC2)CC
Start Substs in Alk. Biosynthesis (Prediction) L-Pro L-Lys L-Arg L-Ala
Organism
Kingdom Family Species Reference
--Neofolitispa dianchora Ref.
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