input word = C00057584

Metabolite InformationStructural formula
Name Nigramide E
Formula C36H40N2O6
Mw 596.28863702
CAS RN 847552-86-7
C_ID C00057584
InChIKey GREGGMAPGMHDBQ-CCEVYBDZSA-N
InChICode InChI=1S/C36H40N2O6/c39-35(37-17-3-1-4-18-37)29-14-12-27(11-7-25-9-15-30-32(21-25)43-23-41-30)28(34(29)36(40)38-19-5-2-6-20-38)13-8-26-10-16-31-33(22-26)44-24-42-31/h7-16,21-22,27-29,34H,1-6,17-20,23-24H2/b11-7+,13-8+/t27-,28-,29?,34+/m1/s1
SMILES O=C(C1C=C[C@@H](/C=C/c2ccc3c(c2)OCO3)[C@@H](/C=C/c2ccc3c(c2)OCO3)[C@@H]1C(=O)N1CCCCC1)N1CCCCC1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaePiperaceaePiper nigrum Ref.
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