input word = C00015782

Metabolite InformationStructural formula
Name Gnetin J
Formula C42H32O10
Mw 696.19954724
CAS RN 152511-23-4
C_ID C00015782 ,
InChIKey MZZSUXPEXUEIAK-HOMRZEAKNA-N
InChICode InChI=1S/C42H32O10/c43-27-8-3-21(4-9-27)1-2-22-13-33(49)39-35(14-22)51-41(23-5-10-28(44)11-6-23)38(39)26-18-34(50)40-36(19-26)52-42(24-7-12-31(47)32(48)17-24)37(40)25-15-29(45)20-30(46)16-25/h1-20,37-38,41-50H/b2-1+/t37-,38+,41+,42-/m1/s1
SMILES Oc1ccc(/C=C/c2cc(O)c3c(c2)OC(c2ccc(O)cc2)[C@@H]3c2cc(O)c3c(c2)O[C@H](c2ccc(O)c(O)c2)[C@H]3c2cc(O)cc(O)c2)cc1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeGnetaceaeGnetum venosum Ref.
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OrganismGnetum venosum
ReferenceBoralle,Phytochem.,34,(1993),1403