input word = C00003930

Metabolite InformationStructural formula
Name Acerosin
3',5,7-Trihydroxy-4',6,8-trimethoxyflavone
5,7-Dihydroxy-2-(3-hydroxy-4-methoxyphenyl)-6,8-dimethoxy-4H-1-benzopyran-4-one
Formula C18H16O8
Mw 360.08451749
CAS RN 15835-74-2
C_ID C00003930 ,
InChIKey BTMNGQCCCWTUQH-UHFFFAOYSA-N
InChICode InChI=1S/C18H16O8/c1-23-11-5-4-8(6-9(11)19)12-7-10(20)13-14(21)17(24-2)15(22)18(25-3)16(13)26-12/h4-7,19,21-22H,1-3H3
SMILES COc1ccc(-c2cc(=O)c3c(O)c(OC)c(O)c(OC)c3o2)cc1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeCalycadenia spp. Ref.
PlantaeAsteraceaeHelianthus strumosus Ref.
PlantaeAsteraceaeIva acerosa Ref.
PlantaeBiebersteiniaceaeBiebersteinia orphanidis Ref.
PlantaeLabiataeVitex negundo Ref.
PlantaeRubiaceaeGardenia spp. Ref.
PlantaeRutaceaeCitrus reticulata Ref.
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OrganismVitex negundo
ReferenceHarborne,Phytochemical Dictionary Second Edition,Taylor and Francis,(1999),Chapter37