input word = C00028044

Metabolite InformationStructural formula
Name Chilocorine B
Formula C26H34N2O
Mw 390.26711372
CAS RN 166990-22-3
C_ID C00028044 ,
InChIKey QLSDOXSAZWDYGQ-UHFFFAOYNA-N
InChICode InChI=1S/C26H34N2O/c1-17-13-19-5-3-10-24-11-4-12-26(14-17,28(19)24)25(16-24)15-20-6-9-23(29)22-8-7-21(18(25)2)27(20)22/h7-8,17,19-20H,2-6,9-16H2,1H3/t17-,19-,20-,24+,25+,26+/m1/s1
SMILES C1[C@@H](C[C@@H]2N3[C@]41CCC[C@@]3(CCC2)C[C@]14C(=C)c2n3[C@@H](C1)CCC(=O)c3cc2)C
Start Substs in Alk. Biosynthesis (Prediction) L-Pro L-Lys
Organism
Kingdom Family Species Reference
AnimaliaCoccinellidaeChilocorus cacti Ref.
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OrganismChilocorus cacti
ReferenceShi,Tetrahedron,51,(1995),8711