input word = C00001759

Metabolite InformationStructural formula
Name Psychotridine
Formula C55H62N10
Mw 862.51589205
CAS RN 52617-25-1
C_ID C00001759 ,
InChIKey DVJSMVZSIBHXAO-UHFFFAOYNA-N
InChICode InChI=1S/C55H62N10/c1-61-28-23-51(33-13-6-8-21-41(33)56-46(51)61)35-15-10-16-36-43(35)58-48-53(36,25-30-63(48)3)38-18-12-20-40-45(38)60-50-55(40,27-32-65(50)5)54-26-31-64(4)49(54)59-44-37(17-11-19-39(44)54)52-24-29-62(2)47(52)57-42-22-9-7-14-34(42)52/h6-22,46-50,56-60H,23-32H2,1-5H3/t46-,47+,48+,49-,50-,51+,52+,53+,54+,55+/m1/s1
SMILES CN1CCC2(c3cccc4c3NC3N(C)CCC43c3cccc4c3NC3N(C)CCC43C34CCN(C)C3Nc3c(C56CCN(C)C5Nc5ccccc56)cccc34)c3ccccc3NC12
Start Substs in Alk. Biosynthesis (Prediction) L-Trp Anthranilate
Organism
Kingdom Family Species Reference
PlantaeRubiaceaePsychotria beccarioides Ref.
PlantaeRubiaceaePsychotria beccaroides Ref.
PlantaeRubiaceaePsychotria colorata Ref.
PlantaeRubiaceaePsychotria oleoides Ref.
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OrganismPsychotria beccarioides
ReferenceHart,Aust.J.Chem.,27,(1974),639