input word = C00001000

Metabolite InformationStructural formula
Name Sanggenon C
Formula C40H36O12
Mw 708.22067662
CAS RN 80651-76-9
C_ID C00001000 ,
InChIKey XETHJOZXBVWLLM-XKZYWWHCNA-N
InChICode InChI=1S/C40H36O12/c1-18(2)10-11-39-27-9-6-22(43)16-31(27)52-40(39,50)38(49)35-32(51-39)17-30(46)34(37(35)48)26-13-19(3)12-25(23-7-4-20(41)14-28(23)44)33(26)36(47)24-8-5-21(42)15-29(24)45/h4-10,13-17,25-26,33,41-46,48,50H,11-12H2,1-3H3/t25-,26+,33-,39-,40-/m1/s1
SMILES c1(c(c(c2c(c1)O[C@]1([C@@](C2=O)(Oc2c1ccc(c2)O)O)CC=C(C)C)O)[C@@H]1[C@@H]([C@H](CC(=C1)C)c1ccc(cc1O)O)C(=O)c1c(cc(cc1)O)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeMoraceaeMorus alba Ref.
PlantaeMoraceaeMorus cathayana Ref.
PlantaeMoraceaeMorus mongolica Ref.
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