input word = C00027051

Metabolite InformationStructural formula
Name Macrogentine
Formula C21H26N2O3
Mw 354.19434271
CAS RN 301521-94-8
C_ID C00027051 ,
InChIKey FUFCKBIZSJGNAI-UIGUQYEWNA-N
InChICode InChI=1S/C21H26N2O3/c1-12(24)8-14-9-19-21(10-18-15(14)11-26-13(2)23(18)19)16-6-4-5-7-17(16)22(3)20(21)25/h4-7,13-15,18-19H,8-11H2,1-3H3/t13-,14-,15-,18+,19+,21+/m1/s1
SMILES [C@@H]1(CC(=O)C)C[C@H]2[C@]3(C(=O)N(c4c3cccc4)C)C[C@@H]3N2[C@H](OC[C@H]13)C
Start Substs in Alk. Biosynthesis (Prediction) Secologanin
Organism
Kingdom Family Species Reference
PlantaeApocynaceaeAlstonia angustifolia Ref.
PlantaeApocynaceaeAlstonia angustifolia var.latifolia Ref.
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