input word = C00028422

Metabolite InformationStructural formula
Name Kamaline
Formula C26H31NO9
Mw 501.1998816
CAS RN 157207-94-8
C_ID C00028422 ,
InChIKey XPLYQICAQFRBTJ-MLQSMQHPNA-N
InChICode InChI=1S/C26H31NO9/c1-3-34-26(32)27-9-8-14-11-17(35-25-23(31)22(30)21(29)18(12-28)36-25)24(33-2)20-15-7-5-4-6-13(15)10-16(27)19(14)20/h4-7,11,16,18,21-23,25,28-31H,3,8-10,12H2,1-2H3/t16-,18-,21-,22+,23-,25-/m1/s1
SMILES c12c(C[C@@H]3c4c1c(c(cc4CCN3C(=O)OCC)O[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O)OC)cccc2
Start Substs in Alk. Biosynthesis (Prediction) L-Trp Secologanin
Organism
Kingdom Family Species Reference
PlantaeMenispermaceaeStephania venosa Ref.
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