input word = C00041503

Metabolite InformationStructural formula
Name Difucol hexa-acetate
Formula C24H22O12
Mw 502.11112617
CAS RN 57103-39-6
C_ID C00041503 ,
InChIKey JODOSPDJXVKRLN-UHFFFAOYSA-N
InChICode InChI=1S/C24H22O12/c1-11(25)31-17-7-19(33-13(3)27)23(20(8-17)34-14(4)28)24-21(35-15(5)29)9-18(32-12(2)26)10-22(24)36-16(6)30/h7-10H,1-6H3
SMILES CC(=O)Oc1cc(OC(C)=O)c(-c2c(OC(C)=O)cc(OC(C)=O)cc2OC(C)=O)c(OC(C)=O)c1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
ChromalveolataSargassaceaeCystophora retroflexa Ref.
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