input word = C00027705

Metabolite InformationStructural formula
Name 19alpha-Hydroxygelsamydine
Formula C29H36N2O7
Mw 524.25225152
CAS RN 181948-91-4
C_ID C00027705 ,
InChIKey JKNZWTBHBQUFIY-RGKOEGBENA-N
InChICode InChI=1S/C29H36N2O7/c1-14-8-22-24(17(14)12-32)16(26(33)38-22)10-28(2,35)25-15-9-23-29(11-20(30-25)18(15)13-37-23)19-6-4-5-7-21(19)31(36-3)27(29)34/h4-7,14-18,20,22-24,32,35H,8-13H2,1-3H3/t14-,15+,16-,17+,18-,20-,22-,23+,24-,28+,29-/m0/s1
SMILES CON1C(=O)[C@@]2(C[C@@H]3N=C([C@](C)(O)C[C@@H]4C(=O)O[C@H]5C[C@H](C)[C@@H](CO)[C@H]54)[C@@H]4C[C@H]2OC[C@H]34)c2ccccc21
Start Substs in Alk. Biosynthesis (Prediction) L-Trp Secologanin
Organism
Kingdom Family Species Reference
PlantaeGelsemiaceaeGelsemium elegans Ref.
zoom in