input word = C00063904

Metabolite InformationStructural formula
Name Hazaleanin A
Formula C39H50O17
Mw 790.30480017
CAS RN 147742-22-1
C_ID C00063904
InChIKey OJQYRNFQILLTRY-UHFFFAOYSA-N
InChICode InChI=1S/C39H50O17/c1-48-25-11-20(12-26(49-2)33(25)42)7-8-32(41)54-19-31-36(45)37(46)38(47)39(56-31)55-18-24(10-22-15-29(52-5)35(44)30(16-22)53-6)23(17-40)9-21-13-27(50-3)34(43)28(14-21)51-4/h7-8,11-16,23-24,31,36-40,42-47H,9-10,17-19H2,1-6H3
SMILES COc1cc(C=CC(=O)OCC2OC(OCC(Cc3cc(OC)c(O)c(OC)c3)C(CO)Cc3cc(OC)c(O)c(OC)c3)C(O)C(O)C2O)cc(OC)c1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeLinaceaeLinum usitatissimum Ref.
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