input word = C00031604

Metabolite InformationStructural formula
Name Apterin
Formula C20H24O10
Mw 424.13694699
CAS RN 53947-89-0
C_ID C00031604 ,
InChIKey ALEQYOXVXJKFOM-UHFFFAOYNA-N
InChICode InChI=1S/C20H24O10/c1-20(2,30-19-16(26)15(25)13(23)10(7-21)28-19)18-14(24)12-9(27-18)5-3-8-4-6-11(22)29-17(8)12/h3-6,10,13-16,18-19,21,23-26H,7H2,1-2H3/t10-,13-,14+,15+,16-,18-,19+/m0/s1
SMILES c1(=O)ccc2c(o1)c1c(cc2)O[C@@H]([C@@H]1O)C(O[C@@H]1[C@H]([C@@H]([C@H]([C@@H](O1)CO)O)O)O)(C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeApiaceaeAngelica furcijuga KITAGAWA Ref.
PlantaeApiaceaeHeracleum mantegazzianium Ref.
PlantaeApiaceaeHeracleum thomsonii Ref.
PlantaeApiaceaeSeseli montanum Ref.
PlantaeApiaceaeZizia aptera Ref.
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OrganismZizia aptera
ReferenceSteck,Phytochem.,13,(1974),1925

Hata,Chem.Pharm.Bull.,22,(1974),957