input word = C00031615

Metabolite InformationStructural formula
Name Aviculin
(+)-Aviculin
Formula C26H34O10
Mw 506.21519731
CAS RN 156765-33-2
C_ID C00031615 ,
InChIKey AVAZTTIAQSFWRK-JGZPALAJNA-N
InChICode InChI=1S/C26H34O10/c1-12-23(29)24(30)25(31)26(36-12)35-11-16-19(32-2)8-14-9-21(34-4)18(28)10-15(14)22(16)13-5-6-17(27)20(7-13)33-3/h5-7,9-10,12,16,19,22-31H,8,11H2,1-4H3/t12-,16-,19+,22-,23-,24+,25+,26+/m0/s1
SMILES COc1cc([C@H]2c3cc(O)c(OC)cc3C[C@@H](OC)[C@@H]2CO[C@@H]2O[C@@H](C)[C@H](O)[C@@H](O)[C@H]2O)ccc1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeEuphorbiaceaeMallotus furetianus Ref.
PlantaeFagaceaeCastanea mollissima Ref.
PlantaeLoranthaceaeScurrula atropurpurea Ref.
PlantaeRosaceaeChaenomeles sinensis KOEHNE Ref.
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OrganismChaenomeles sinensis KOEHNE
ReferenceGao,Chem.Pharm.Bull.,51,(2003),1318