input word = C00001738

Metabolite InformationStructural formula
Name Hodgkinsine
Formula C33H38N6
Mw 518.31579526
CAS RN 18210-71-4
C_ID C00001738 ,
InChIKey DPVWJPVYOXKFRQ-KEBQXPEONA-N
InChICode InChI=1S/C33H38N6/c1-37-18-15-31(21-9-4-6-13-25(21)34-28(31)37)23-11-8-12-24-27(23)36-30-33(24,17-20-39(30)3)32-16-19-38(2)29(32)35-26-14-7-5-10-22(26)32/h4-14,28-30,34-36H,15-20H2,1-3H3/t28-,29+,30-,31-,32-,33+/m1/s1
SMILES [C@@]12(c3c(N[C@H]1N(CC2)C)cccc3)[C@@]12c3c(N[C@@H]1N(CC2)C)c(ccc3)[C@@]12c3c(N[C@@H]1N(CC2)C)cccc3
Start Substs in Alk. Biosynthesis (Prediction) L-Trp Anthranilate
Organism
Kingdom Family Species Reference
PlantaeRubiaceaeHodgkinsonia frutescens Ref.
PlantaeRubiaceaePsychotria colorata Ref.
PlantaeRubiaceaePsychotria lyciiflora Ref.
PlantaeRubiaceaePsychotria malayana Ref.
PlantaeRubiaceaePsychotria oleoides Ref.
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OrganismHodgkinsonia frutescens
ReferenceHarborne,Phytochemical Dictionary Second Edition,Taylor and Francis,(1999),Chapter20