input word = C00044166

Metabolite InformationStructural formula
Name Ethyl N-methylpiperidine-3-carboxylate
Formula C27H32F3N5O5S
Mw 595.2076245
CAS RN 635751-83-6
C_ID C00044166 ,
InChIKey RRKXWMODKLBAGM-UHFFFAOYNA-N
InChICode InChI=1S/C27H32F3N5O5S/c1-18-21(31-11-8-23(18)40-17-27(28,29)30)16-41(38)25-32-20-6-4-5-7-22(20)35(25)26(37)34(3)14-15-39-24(36)19-9-12-33(2)13-10-19/h4-8,11,19H,9-10,12-17H2,1-3H3/t41-/m1/s1
SMILES c12c(cccc1)nc(n2C(=O)N(CCOC(=O)C1CCN(CC1)C)C)[S@](=O)Cc1nccc(c1C)OCC(F)(F)F
Start Substs in Alk. Biosynthesis (Prediction) L-Trp L-Pro IPP
Organism
Kingdom Family Species Reference
PlantaePalmaeAreca catechu Ref.
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