input word = C00050276

Metabolite InformationStructural formula
Name Batzelladine E
Formula C27H46N6O2
Mw 486.36822476
CAS RN 161503-25-9
C_ID C00050276 ,
InChIKey LMIRNBRTDWHRJM-MRVYAHGINA-N
InChICode InChI=1S/C27H46N6O2/c1-3-5-7-8-10-13-20-19-21-15-16-23-24(25(34)35-18-12-11-17-30-26(28)29)22(14-9-6-4-2)32-27(31-20)33(21)23/h7-8,20-21,23H,3-6,9-19H2,1-2H3,(H,31,32)(H4,28,29,30)/b8-7-/t20-,21+,23-/m0/s1
SMILES C1(=C([C@H]2N3C(=N[C@H](C[C@H]3CC2)CC/C=C\CCC)N1)C(=O)OCCCCNC(=N)N)CCCCC
Start Substs in Alk. Biosynthesis (Prediction) L-Pro L-Lys L-Arg L-Ala
Organism
Kingdom Family Species Reference
--Batzella sp. Ref.
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