input word = C00029036

Metabolite InformationStructural formula
Name Specioseine
Formula C27H29NO6
Mw 463.19948767
CAS RN 142735-47-5
C_ID C00029036 ,
InChIKey LRKICIBMVROIRW-GNLPSFAGNA-N
InChICode InChI=1S/C27H29NO6/c1-28(15-17-7-5-6-8-21(17)29)20-11-9-16-13-24(32-2)26(33-3)27(34-4)25(16)18-10-12-22(30)23(31)14-19(18)20/h5-8,10,12-14,20,29H,9,11,15H2,1-4H3,(H,30,31)/t20-/m0/s1
SMILES c1c(c(=O)cc2c(c1)c1c(CC[C@@H]2N(Cc2ccccc2O)C)cc(c(c1OC)OC)OC)O
Start Substs in Alk. Biosynthesis (Prediction) L-Tyr Anthranilate
Organism
Kingdom Family Species Reference
PlantaeColchicaceaeColchicum speciosum Ref.
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