input word = C00057581

Metabolite InformationStructural formula
Name Nigramide B
Formula C34H38N2O6
Mw 570.27298696
CAS RN 847552-83-4
C_ID C00057581
InChIKey VQMWKHMWENQJCY-NBCPFKEQSA-N
InChICode InChI=1S/C34H38N2O6/c37-33(35-15-3-1-4-16-35)27-12-11-25(24-9-14-29-31(20-24)42-22-40-29)32(34(38)36-17-5-2-6-18-36)26(27)10-7-23-8-13-28-30(19-23)41-21-39-28/h7-14,19-20,25-27,32H,1-6,15-18,21-22H2/b10-7+/t25-,26-,27-,32-/m1/s1
SMILES O=C([C@H]1[C@H](/C=C/c2ccc3c(c2)OCO3)[C@H](C(=O)N2CCCCC2)C=C[C@@H]1c1ccc2c(c1)OCO2)N1CCCCC1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaePiperaceaePiper nigrum Ref.
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