input word = C00030473

Metabolite InformationStructural formula
Name Heptazoline
Formula C18H17NO3
Mw 295.12084342
CAS RN 32042-35-6
C_ID C00030473 ,
InChIKey LITFGIKRRVPXCE-UHFFFAOYSA-N
InChICode InChI=1S/C18H17NO3/c1-10(2)6-7-13-16-14(8-11(9-20)18(13)22)12-4-3-5-15(21)17(12)19-16/h3-6,8-9,19,21-22H,7H2,1-2H3
SMILES c12c(c3c([nH]1)c(ccc3)O)cc(c(c2CC=C(C)C)O)C=O
Start Substs in Alk. Biosynthesis (Prediction) L-Tyr Anthranilate
Organism
Kingdom Family Species Reference
PlantaeRutaceaeClausena excavata Ref.
PlantaeRutaceaeClausena heptaphylla Wt.et Arn. Ref.
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