input word = C00001692

Metabolite InformationStructural formula
Name Borrerine
Formula C16H20N2
Mw 240.16264865
CAS RN 51076-19-8
C_ID C00001692 ,
InChIKey RCNFEGDNDAQFRX-UHFFFAOYNA-N
InChICode InChI=1S/C16H20N2/c1-11(2)10-15-16-13(8-9-18(15)3)12-6-4-5-7-14(12)17-16/h4-7,10,15,17H,8-9H2,1-3H3/t15-/m1/s1
SMILES c1cccc2c1c1c([nH]2)[C@H](N(CC1)C)C=C(C)C
Start Substs in Alk. Biosynthesis (Prediction) L-Trp Anthranilate
Organism
Kingdom Family Species Reference
PlantaeRubiaceaeBorreria verticillata Ref.
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OrganismBorreria verticillata
ReferenceHarborne,Phytochemical Dictionary Second Edition,Taylor and Francis,(1999),Chapter20