input word = C00014754

Metabolite InformationStructural formula
Name Taiwanhomoflavone C
Formula C66H50O21
Mw 1178.28445866
CAS RN 750643-00-6
C_ID C00014754 ,
InChIKey HIXAHAAXXUDFLS-UHFFFAOYNA-N
InChICode InChI=1S/C66H50O21/c1-27-46(81-4)25-53-56(62(27)75)38(69)19-47(86-53)28-7-11-36(67)32(15-28)34-17-30(9-13-44(34)79-2)49-20-39(70)57-51(84-49)23-42(73)60(63(57)76)61-43(74)24-52-58(64(61)77)40(71)21-50(85-52)31-10-14-45(80-3)35(18-31)33-16-29(8-12-37(33)68)48-22-41(72)59-54(87-48)26-55(82-5)66(83-6)65(59)78/h7-19,22-26,49-50,67-68,73-78H,20-21H2,1-6H3/t49-,50+/m0/s1
SMILES COc1ccc(C2CC(=O)c3c(cc(O)c(-c4c(O)cc5c(c4O)C(=O)CC(c4ccc(OC)c(-c6cc(-c7cc(=O)c8c(O)c(OC)c(OC)cc8o7)ccc6O)c4)O5)c3O)O2)cc1-c1cc(-c2cc(=O)c3c(O)c(C)c(OC)cc3o2)ccc1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeCephalotaxaceaeCephalotaxus wilsoniana Ref.
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OrganismCephalotaxus wilsoniana
ReferenceMessange,New.J.Chem.,25,(2001),1098