input word = C00026945

Metabolite InformationStructural formula
Name (1S)-1,2,3,4-Tetrahydromanzamine B
Formula C36H50N4O
Mw 554.39846225
CAS RN 220706-23-0
C_ID C00026945 ,
InChIKey NNZHASOWBAIFFH-SOSXVSKCNA-N
InChICode InChI=1S/C36H50N4O/c1-3-7-13-21-38-34-35(19-11-5-1)25-40-23-14-8-4-2-6-12-20-36(34)33(41-36)30(28(35)18-24-40)32-31-27(17-22-37-32)26-15-9-10-16-29(26)39-31/h1-2,5-6,9-10,15-16,28,30,32-34,37-39H,3-4,7-8,11-14,17-25H2/b5-1-,6-2+/t28-,30-,32+,33-,34+,35-,36-/m0/s1
SMILES [C@]123CC/C=C/CCCCN4CC[C@@H]([C@@H]([C@@H]5c6c(c7ccccc7[nH]6)CCN5)[C@@H]2O3)[C@@]2([C@H]1NCCCC/C=C\CC2)C4
Start Substs in Alk. Biosynthesis (Prediction) L-Trp L-Lys
Organism
Kingdom Family Species Reference
AnimaliaNiphatidaeAmphimedon sp. Ref.
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