input word = C00050668

Metabolite InformationStructural formula
Name 2alpha-Hydroxytirotundin
Formula C19H28O7
Mw 368.18350325
CAS RN 430467-34-8
C_ID C00050668
InChIKey UFLGQPOBCWRADC-DDGZPGRUNA-N
InChICode InChI=1S/C19H28O7/c1-9(2)16(21)25-13-7-18(5)8-14(20)19(23,26-18)10(3)6-12-15(13)11(4)17(22)24-12/h9-10,12-15,20,23H,4,6-8H2,1-3,5H3/t10-,12+,13+,14+,15-,18-,19-/m0/s1
SMILES C=C1C(=O)O[C@@H]2C[C@H](C)[C@]3(O)O[C@](C)(C[C@H]3O)C[C@@H](OC(=O)C(C)C)[C@@H]12
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeTithonia diversifolia Ref.
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