input word = C00052000

Metabolite InformationStructural formula
Name Echitovenine
Formula C23H28N2O4
Mw 396.2049074
CAS RN
C_ID C00052000
InChIKey
InChICode InChI=1S/C23H28N2O4/c1-14(29-15(2)26)22-9-6-11-25-12-10-23(21(22)25)17-7-4-5-8-18(17)24-19(23)16(13-22)20(27)28-3/h4-5,7-8,14,21,24H,6,9-13H2,1-3H3/t14?,21-,22-,23-/m0/s1
SMILES COC(=O)C1=C2Nc3ccccc3[C@@]23CCN2CCC[C@@](C(C)OC(C)=O)(C1)[C@H]23
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeApocynaceaeCatharanthus roseus Ref.
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