input word = C00036030

Metabolite InformationStructural formula
Name Afzelone A
Formula C31H24O9
Mw 540.14203237
CAS RN 623147-68-2
C_ID C00036030 ,
InChIKey YBNWSGJTIRDUAL-VKXHVINBNA-N
InChICode InChI=1S/C31H24O9/c1-38-19-9-4-16(5-10-19)31-28(29(36)20-11-8-18(33)12-21(20)34)27-25(40-31)14-24-26(30(27)37)22(35)13-23(39-24)15-2-6-17(32)7-3-15/h2-12,14,23,28,31-34,37H,13H2,1H3/t23-,28+,31+/m0/s1
SMILES [C@@H]1(Oc2c([C@@H]1C(=O)c1c(cc(cc1)O)O)c(c1c(c2)O[C@@H](CC1=O)c1ccc(cc1)O)O)c1ccc(cc1)OC
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeOchnaceaeOchna afzelii Ref.
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