input word = C00051172

Metabolite InformationStructural formula
Name Kurchaline
Formula C23H37NO2
Mw 359.28242943
CAS RN 6885-72-9
C_ID C00051172
InChIKey LWZNDYKDUGVSBN-OWOGMRGBNA-N
InChICode InChI=1S/C23H37NO2/c1-6-16-20(25)12-18-15-8-7-14-11-19(24(4)5)21(26)13-23(14,3)17(15)9-10-22(16,18)2/h6-7,15,17-21,25-26H,8-13H2,1-5H3/b16-6+/t15-,17+,18+,19-,20-,21-,22-,23+/m1/s1
SMILES C/C=C1[C@H](O)C[C@H]2[C@@H]3CC=C4C[C@@H](N(C)C)[C@H](O)C[C@]4(C)[C@H]3CC[C@]12C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeApocynaceaeHolarrhena antidysenterica Ref.
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OrganismHolarrhena antidysenterica
ReferenceEdited by Jiangsu New Medicinal College, Chinese Medicine Dictionary, Shanghai Science and technology Press, Shanghai, (1979)