input word = C00025722

Metabolite InformationStructural formula
Name 17-Epialloyohimbine
17-epi-Alloyohimbine
Formula C21H26N2O3
Mw 354.19434271
CAS RN 59952-56-6
C_ID C00025722 ,
InChIKey BLGXFZZNTVWLAY-YHJCIPLRNA-N
InChICode InChI=1S/C21H26N2O3/c1-26-21(25)19-15-10-17-20-14(13-4-2-3-5-16(13)22-20)8-9-23(17)11-12(15)6-7-18(19)24/h2-5,12,15,17-19,22,24H,6-11H2,1H3/t12-,15-,17+,18-,19-/m1/s1
SMILES COC(=O)[C@@H]1[C@H]2C[C@H]3c4[nH]c5ccccc5c4CCN3C[C@H]2CC[C@H]1O
Start Substs in Alk. Biosynthesis (Prediction) L-Trp Secologanin
Organism
Kingdom Family Species Reference
PlantaeApocynaceaeAspidosperma oblongum Ref.
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