input word = C00028022

Metabolite InformationStructural formula
Name Ceratinamide A
(-)-Ceratinamide A
Formula C22H23Br4N3O7
Mw 756.82695171
CAS RN 178214-21-6
C_ID C00028022 ,
InChIKey ZKHAUYSBCGRQON-MGRUGCKGNA-N
InChICode InChI=1S/C22H23Br4N3O7/c1-33-18-15(25)9-22(35-10-16(18)26)20(31)17(29-36-22)21(32)28-4-2-6-34-19-13(23)7-12(8-14(19)24)3-5-27-11-30/h7-8,10-11,20,31H,2-6,9H2,1H3,(H,27,30)(H,28,32)/t20-,22-/m0/s1
SMILES c1c(cc(c(c1Br)OCCCNC(=O)C1=NO[C@@]2([C@H]1O)OC=C(C(=C(C2)Br)OC)Br)Br)CCNC=O
Start Substs in Alk. Biosynthesis (Prediction) L-Pro L-Lys
Organism
Kingdom Family Species Reference
--Pseudoceratina purpurea Ref.
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