input word = C00001001

Metabolite InformationStructural formula
Name Sanggenon D
Formula C40H36O12
Mw 708.22067662
CAS RN 81422-93-7
C_ID C00001001 ,
InChIKey SUOXGDJCEWTZIZ-UHFFFAOYNA-N
InChICode InChI=1S/C40H36O12/c1-18(2)10-11-39-38(49)35-32(52-40(39,50)27-9-6-22(43)16-31(27)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(cc(cc1)O)O)C(=O)[C@H]1[C@@H](C=C(C[C@@H]1c1ccc(cc1O)O)C)c1c(cc2c(c1O)C(=O)[C@@]1([C@](O2)(c2c(O1)cc(cc2)O)O)CC=C(C)C)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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