input word = C00002021

Metabolite InformationStructural formula
Name Astrocasine
Formula C20H26N2O
Mw 310.20451347
CAS RN 2114-92-3
C_ID C00002021 ,
InChIKey SYCAKKSJEGVPOL-NGOFJIMYNA-N
InChICode InChI=1S/C20H26N2O/c1-21-13-5-4-8-18(21)16-9-11-19-17-7-3-2-6-15(17)10-12-20(23)22(19)14-16/h2-3,6-7,10,12,16,18-19H,4-5,8-9,11,13-14H2,1H3/t16-,18+,19+/m0/s1
SMILES C1N([C@H](CCC1)[C@@H]1CN2[C@H](CC1)c1c(C=CC2=O)cccc1)C
Start Substs in Alk. Biosynthesis (Prediction) L-Trp L-Lys
Organism
Kingdom Family Species Reference
PlantaePhyllanthaceaeAstrocasia phyllantoides Ref.
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OrganismAstrocasia phyllantoides
ReferenceHarborne,Phytochemical Dictionary Second Edition,Taylor and Francis,(1999),Chapter25