input word = C00001786

Metabolite InformationStructural formula
Name Vobasine
Formula C21H24N2O3
Mw 352.17869265
CAS RN 2134-83-0
C_ID C00001786 ,
InChIKey TYPMTMPLTVSOBU-XTDGOYHBNA-N
InChICode InChI=1S/C21H24N2O3/c1-4-12-11-23(2)17-9-15-13-7-5-6-8-16(13)22-20(15)18(24)10-14(12)19(17)21(25)26-3/h4-8,14,17,19,22H,9-11H2,1-3H3/b12-4-/t14-,17-,19+/m1/s1
SMILES c1cc2c(cc1)c1c([nH]2)C(=O)C[C@H]2[C@@H]([C@@H](C1)N(C/C/2=C/C)C)C(=O)OC
Start Substs in Alk. Biosynthesis (Prediction) L-Trp Secologanin
Organism
Kingdom Family Species Reference
PlantaeApocynaceaeErvatamia hainanensis Ref.
PlantaeApocynaceaeErvatamia officinalis Ref.
PlantaeApocynaceaeHunteria zeylanica Ref.
PlantaeApocynaceaePeschiera lacta Ref.
PlantaeApocynaceaeTabernaemontana dichotoma Ref.
PlantaeApocynaceaeTabernaemontana elegans Stapf. Ref.
PlantaeApocynaceaeTabernaemontana odoratissima Ref.
PlantaeApocynaceaeTrachelospermum jasminoides Ref.
PlantaeApocynaceaeVoacanga africana Ref.
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OrganismTabernaemontana elegans Stapf.
ReferenceVan der Heijden,Planta Med.,(1986),144