input word = C00006077

Metabolite InformationStructural formula
Name Gossypetin 7,8-dimethyl ether 3,3'-disulfate
2-[4-Hydroxy-3-(sulfooxy)phenyl]-5-hydroxy-7,8-dimethoxy-3-(sulfooxy)-4H-1-benzopyran-4-one
Formula C17H14O14S2
Mw 505.98249662
CAS RN 164163-87-5
C_ID C00006077 ,
InChIKey SZBZAAQLURKCJZ-UHFFFAOYSA-N
InChICode InChI=1S/C17H14O14S2/c1-27-11-6-9(19)12-13(20)17(31-33(24,25)26)14(29-16(12)15(11)28-2)7-3-4-8(18)10(5-7)30-32(21,22)23/h3-6,18-19H,1-2H3,(H,21,22,23)(H,24,25,26)
SMILES c1(cc(c2c(c1OC)oc(c(c2=O)OS(=O)(=O)O)c1ccc(c(c1)OS(=O)(=O)O)O)O)OC
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeEricaceaeErica cinerea Ref.
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