input word = C00047727

Metabolite InformationStructural formula
Name Arisanschinin H
Formula C27H32O9
Mw 500.20463262
CAS RN 1181216-80-7
C_ID C00047727 ,
InChIKey FCTUIBJAFLZNCK-JYRVWZFONA-N
InChICode InChI=1S/C27H32O9/c1-8-13(2)26(29)36-25-16-11-18-23(35-12-34-18)24(33-7)20(16)19-15(9-14(3)27(25,4)30)10-17(31-5)22(32-6)21(19)28/h8,10-11,14,25,28,30H,9,12H2,1-7H3/b13-8-/t14-,25+,27+/m1/s1
SMILES C/C=C(/C)C(=O)OC1c2cc3c(c(OC)c2-c2c(cc(OC)c(OC)c2O)CC(C)C1(C)O)OCO3
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeSchisandraceaeSchisandra arisanensis Ref.
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