input word = C00002005

Metabolite InformationStructural formula
Name Mucronine B
Formula C28H36N4O4
Mw 492.27365567
CAS RN 38840-26-5
C_ID C00002005 ,
InChIKey HBLUGHSSFJXCOA-QYLZUMIYNA-N
InChICode InChI=1S/C28H36N4O4/c1-5-18(2)25-28(35)31-23(16-19-9-7-6-8-10-19)26(33)30-14-13-20-11-12-24(36-4)21(15-20)17-22(29-3)27(34)32-25/h6-15,18,22-23,25,29H,5,16-17H2,1-4H3,(H,30,33)(H,31,35)(H,32,34)/b14-13-/t18-,22-,23-,25-/m0/s1
SMILES c1(c2cc(cc1)/C=C\NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@@H](NC)C2)[C@H](CC)C)OC
Start Substs in Alk. Biosynthesis (Prediction) L-Trp
Organism
Kingdom Family Species Reference
PlantaeRhamnaceaeZiziphus mucronata Ref.
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