input word = C00008082

Metabolite InformationStructural formula
Name Artonin X
Formula C40H38O9
Mw 662.25158281
CAS RN 170384-76-6
C_ID C00008082 ,
InChIKey LSWPUMCBBKEXMW-UMPQAJJQNA-N
InChICode InChI=1S/C40H38O9/c1-21(2)4-11-27-33(44)16-14-29(38(27)47)40(49)36-30(26-12-10-25(42)20-35(26)46)18-22(3)19-31(36)37-34(45)17-13-28(39(37)48)32(43)15-7-23-5-8-24(41)9-6-23/h4-10,12-17,19-20,30-31,36,41-42,44-48H,11,18H2,1-3H3/b15-7+/t30-,31+,36-/m1/s1
SMILES CC(C)=CCc1c(O)ccc(C(=O)[C@H]2[C@@H](c3c(O)ccc(C(=O)/C=C/c4ccc(O)cc4)c3O)C=C(C)C[C@@H]2c2ccc(O)cc2O)c1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeMoraceaeArtocarpus heterophyllus Ref.
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