input word = C00049409

Metabolite InformationStructural formula
Name 1',2',3',4'-Tetradehydrotubulosine
Formula C29H33N3O3
Mw 471.25219194
CAS RN 2753-27-7
C_ID C00049409 ,
InChIKey FYIJNEXYFHEJLZ-UHFFFAOYNA-N
InChICode InChI=1S/C29H33N3O3/c1-4-17-16-32-10-8-18-13-27(34-2)28(35-3)15-22(18)26(32)12-19(17)11-25-29-21(7-9-30-25)23-14-20(33)5-6-24(23)31-29/h5-7,9,13-15,17,19,26,31,33H,4,8,10-12,16H2,1-3H3/t17-,19+,26-/m1/s1
SMILES CCC1CN2CCc3cc(OC)c(OC)cc3C2CC1Cc1nccc2c1[nH]c1ccc(O)cc12
Start Substs in Alk. Biosynthesis (Prediction) L-Trp Secologanin
Organism
Kingdom Family Species Reference
PlantaeRubiaceaePogonopus speciosus Ref.
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OrganismPogonopus speciosus
ReferenceIto,J.Nat.Prod.,62,(1999),1346