input word = C00026860

Metabolite InformationStructural formula
Name Manzamine A
Formula C36H44N4O
Mw 548.35151206
CAS RN 104196-68-1
C_ID C00026860 ,
InChIKey FUCSLKWLLSEMDQ-ZVKXWVMDNA-N
InChICode InChI=1S/C36H44N4O/c41-36-18-10-4-1-2-5-11-20-39-22-17-30(35(25-39)23-26-13-7-3-6-12-21-40(26)34(35)36)29(24-36)32-33-28(16-19-37-32)27-14-8-9-15-31(27)38-33/h1,4,7-9,13-16,19,24,26,30,34,38,41H,2-3,5-6,10-12,17-18,20-23,25H2/b4-1+,13-7-/t26-,30-,34+,35-,36-/m0/s1
SMILES [C@]12(C=C(c3c4c(ccn3)c3c([nH]4)cccc3)[C@H]3[C@@]4([C@H]1N1CCCCC=C[C@H]1C4)CN(CC3)CCCC/C=C/CC2)O
Start Substs in Alk. Biosynthesis (Prediction) L-Trp
Organism
Kingdom Family Species Reference
AnimaliaChalinidaeHaliclona sp. Ref.
--Acanthostrongylophora aff .ingens Ref.
--Acanthostrongylophora sp. Ref.
--Pellina sp. Ref.
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