input word = C00027519

Metabolite InformationStructural formula
Name Aristolochic acid IIIa
Aristolochic acid C
Formula C16H9NO7
Mw 327.03790165
CAS RN 4849-90-5
C_ID C00027519 ,
InChIKey NBFGYDJKTHENDP-UHFFFAOYSA-N
InChICode InChI=1S/C16H9NO7/c18-8-2-1-7-3-11(17(21)22)13-10(16(19)20)5-12-15(24-6-23-12)14(13)9(7)4-8/h1-5,18H,6H2,(H,19,20)
SMILES O=C(O)c1cc2c(c3c1c([N+](=O)[O-])cc1ccc(O)cc13)OCO2
Start Substs in Alk. Biosynthesis (Prediction) L-Tyr
Organism
Kingdom Family Species Reference
PlantaeAristolochiaceaeAristolochia debilis Ref.
PlantaeAristolochiaceaeAristolochia heterophylla Hemsl Ref.
PlantaeAristolochiaceaeAristolochia kaempferi Ref.
PlantaeAristolochiaceaeAristolochia manchuriensis Ref.
PlantaeAristolochiaceaeAristolochia tubiflora Ref.
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