input word = C00025224

Metabolite InformationStructural formula
Name Voacangine hydroxyindolenine
7alpha-Hydroxyvoacangine indolenine
Formula C22H28N2O4
Mw 384.2049074
CAS RN 3464-63-9
C_ID C00025224 ,
InChIKey AVRFPRAAVSCSSZ-QEWUZYGLNA-N
InChICode InChI=1S/C22H28N2O4/c1-4-14-9-13-11-21(20(25)28-3)18(14)24(12-13)8-7-22(26)16-10-15(27-2)5-6-17(16)23-19(21)22/h5-6,10,13-14,18,26H,4,7-9,11-12H2,1-3H3/t13-,14+,18+,21+,22-/m1/s1
SMILES CC[C@H]1C[C@H]2C[N@]3CC[C@]4(O)C(=Nc5ccc(OC)cc54)[C@](C(=O)OC)(C2)[C@H]13
Start Substs in Alk. Biosynthesis (Prediction) L-Tyr Secologanin
Organism
Kingdom Family Species Reference
PlantaeApocynaceaeErvatamia coronaria (Jacq.) Ref.
PlantaeApocynaceaeErvatamia divaricata Gouyahua Ref.
PlantaeApocynaceaeTabernaemontana apoda Wr.ex Sauv. Ref.
PlantaeApocynaceaeTabernaemontana cerifera Panch.et Seb. Ref.
PlantaeApocynaceaeTabernaemontana citrifolia L. Ref.
PlantaeApocynaceaeTabernaemontana echinata Vell. Ref.
PlantaeApocynaceaeTabernaemontana macrocarpa Jack Ref.
PlantaeApocynaceaeTabernaemontana olivacea Mull.Arg. Ref.
PlantaeApocynaceaeTabernaemontana quadrangularis Ref.
PlantaeApocynaceaeVoacanga africana Stapf. Ref.
zoom in