input word = C00021746

Metabolite InformationStructural formula
Name 8beta-Hydroxyproustianol angelicate
Formula C24H32O8
Mw 448.209718
CAS RN 69993-64-2
C_ID C00021746 ,
InChIKey GKBCYQZLYMMXKN-ZBVPJXNENA-N
InChICode InChI=1S/C24H32O8/c1-7-11(2)20(28)31-17-8-14-21(29-12(3)25)32-22(30-13(4)26)19-16(27)9-18-23(5,6)15(17)10-24(14,18)19/h7-8,15-19,21-22,27H,9-10H2,1-6H3/b11-7-/t15-,16+,17+,18-,19-,21+,22+,24-/m0/s1
SMILES C/C=C(/C)C(=O)O[C@@H]1C=C2[C@H](OC(C)=O)O[C@@H](OC(C)=O)[C@@H]3[C@H](O)C[C@H]4C(C)(C)[C@H]1C[C@@]234
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeProustia pyrifolia Ref.
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