input word = C00048591

Metabolite InformationStructural formula
Name 6,6'-Bieckol
Formula C36H22O18
Mw 742.0806139
CAS RN 88095-81-2
C_ID C00048591 ,
InChIKey HBJNTPFHQKXWOY-UHFFFAOYSA-N
InChICode InChI=1S/C36H22O18/c37-11-1-12(38)4-15(3-11)49-29-21(45)9-23(47)31-35(29)53-27-19(43)7-17(41)25(33(27)51-31)26-18(42)8-20(44)28-34(26)52-32-24(48)10-22(46)30(36(32)54-28)50-16-5-13(39)2-14(40)6-16/h1-10,37-48H
SMILES c12c(Oc3c(O1)c(cc(c3c1c3Oc4c(Oc3c(cc1O)O)c(c(cc4O)O)Oc1cc(cc(c1)O)O)O)O)c(cc(c2Oc1cc(cc(c1)O)O)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
ChromalveolataLessoniaceaeEcklonia cava Ref.
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