input word = C00026027

Metabolite InformationStructural formula
Name Sciadenine
Formula C37H40N2O6
Mw 608.28863702
CAS RN 59043-23-1
C_ID C00026027 ,
InChIKey KTAONUHTYCZKBS-ZTMACLEXNA-N
InChICode InChI=1S/C37H40N2O6/c1-38-16-14-24-20-30(41-3)34(40)36-32(24)28(38)18-22-8-12-27(13-9-22)45-37-33-25(21-31(42-4)35(37)43-5)15-17-39(2)29(33)19-23-6-10-26(44-36)11-7-23/h6-13,20-21,28-29,40H,14-19H2,1-5H3/t28-,29+/m0/s1
SMILES c12cc(c(c3c1[C@H](N(CC2)C)Cc1ccc(cc1)Oc1c2[C@H](Cc4ccc(O3)cc4)N(CCc2cc(c1O)OC)C)OC)OC
Start Substs in Alk. Biosynthesis (Prediction) L-Tyr L-Phe
Organism
Kingdom Family Species Reference
PlantaeMenispermaceaeSciadotenia toxifera Krukoff Ref.
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OrganismSciadotenia toxifera Krukoff
ReferenceGaleffi,Gazz.Chim.Ital.,108,(1978),97