input word = C00002193

Metabolite InformationStructural formula
Name Quinine
Formula C20H24N2O2
Mw 324.18377802
CAS RN 130-95-0
C_ID C00002193 ,
InChIKey LOUPRKONTZGTKE-GZJAXPACNA-N
InChICode InChI=1S/C20H24N2O2/c1-3-13-12-22-9-7-14(13)10-19(22)20(23)16-6-8-21-18-5-4-15(24-2)11-17(16)18/h3-6,8,11,13-14,19-20,23H,1,7,9-10,12H2,2H3/t13-,14-,19-,20+/m0/s1
SMILES c1(ccc2c(c1)c(ccn2)[C@H]([C@H]1N2C[C@@H]([C@H](C1)CC2)C=C)O)OC
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
FungiDiaporthaceaeDiaporthe sp. CLF-J Ref.
PlantaeRubiaceaeCinchona ledgariana Ref.
PlantaeRubiaceaeCinchona ledgeriana Ref.
PlantaeRubiaceaeCinchona officinalis Ref.
PlantaeRubiaceaeCinchona pelletierana Wedd. Ref.
PlantaeRubiaceaeCinchona pubescens Ref.
PlantaeRubiaceaeCinchona robusta Ref.
PlantaeRubiaceaeCinchona rosulenta Ref.
PlantaeRubiaceaeCinchona sp. Ref.
PlantaeRubiaceaeCinchona spp. Ref.
PlantaeRubiaceaeCinchona succirubra Ref.
PlantaeRubiaceaeRemijia pedunculata Ref.
PlantaeRubiaceaeRemijia peruviana Ref.
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