input word = C00031519

Metabolite InformationStructural formula
Name 18-Demethylpubescenine
18-O-Demethylpubescenine
Formula C25H39NO8
Mw 481.26756723
CAS RN 446859-91-2
C_ID C00031519 ,
InChIKey OSSCNSALANKATQ-UHFFFAOYNA-N
InChICode InChI=1S/C25H39NO8/c1-5-26-10-22(11-27)7-6-16(29)24-14-8-13-15(32-3)9-23(33-4,17(14)18(13)34-12(2)28)25(31,21(24)26)20(30)19(22)24/h13-21,27,29-31H,5-11H2,1-4H3/t13-,14-,15+,16+,17-,18+,19+,20+,21-,22-,23-,24-,25+/m0/s1
SMILES N1(CC)[C@@H]2[C@@]3([C@@H]([C@H]4[C@]2([C@H]2C[C@H]5[C@@H](C[C@@]3([C@@H]2[C@@H]5OC(=O)C)OC)OC)[C@@H](CC[C@]4(C1)CO)O)O)O
Start Substs in Alk. Biosynthesis (Prediction) L-Pro L-Arg Secologanin Cholesterol
Organism
Kingdom Family Species Reference
PlantaeRanunculaceaeConsolida orientalis (GAY) SCHROD. Ref.
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