input word = C00001796

Metabolite InformationStructural formula
Name Alangimarckine
Formula C29H37N3O3
Mw 475.28349207
CAS RN 13849-53-1
C_ID C00001796 ,
InChIKey BZIKDLPHKDIUHH-SAGXBRCRNA-N
InChICode InChI=1S/C29H37N3O3/c1-4-17-16-32-12-10-21-22(15-26(34-2)29(35-3)28(21)33)25(32)14-18(17)13-24-27-20(9-11-30-24)19-7-5-6-8-23(19)31-27/h5-8,15,17-18,24-25,30-31,33H,4,9-14,16H2,1-3H3/t17-,18-,24+,25-/m0/s1
SMILES c1(c(cc2c(c1O)CCN1[C@H]2C[C@@H]([C@H](C1)CC)C[C@@H]1c2c(c3c([nH]2)cccc3)CCN1)OC)OC
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeCornaceae/Aucubaceae/Garryaceae/HelwingiaceaeAlangium lamarckii Ref.
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OrganismAlangium lamarckii
ReferenceHarborne,Phytochemical Dictionary Second Edition,Taylor and Francis,(1999),Chapter21