input word = C00049817

Metabolite InformationStructural formula
Name Malibatol B
Formula C28H20O9
Mw 500.11073224
CAS RN 204644-72-4
C_ID C00049817 ,
InChIKey OTJUFGKCGUDJEI-GREGDHHGNA-N
InChICode InChI=1S/C28H20O9/c29-13-4-1-11(2-5-13)21-23-18(33)10-19(34)27(36)24(23)25-22-15(26(21)35)8-14(30)9-20(22)37-28(25)12-3-6-16(31)17(32)7-12/h1-10,21,26,29-36H/t21-,26-/m1/s1
SMILES c12c([C@H]([C@@H](c3c4c1c(oc4cc(c3)O)c1cc(c(cc1)O)O)O)c1ccc(cc1)O)c(cc(c2O)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeDipterocarpaceaeHopea malibato Ref.
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