input word = C00062176

Metabolite InformationStructural formula
Name Chlorhexidine
Formula C22H30Cl2N10
Mw 504.20319645
CAS RN 55-56-1
C_ID C00062176
InChIKey GHXZTYHSJHQHIJ-UHFFFAOYSA-N
InChICode InChI=1S/C22H30Cl2N10/c23-15-5-9-17(10-6-15)31-21(27)33-19(25)29-13-3-1-2-4-14-30-20(26)34-22(28)32-18-11-7-16(24)8-12-18/h5-12H,1-4,13-14H2,(H5,25,27,29,31,33)(H5,26,28,30,32,34)
SMILES NC(=NCCCCCCN=C(N)N=C(N)Nc1ccc(Cl)cc1)N=C(N)Nc1ccc(Cl)cc1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeMoraceaeMorus alba Ref.
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