input word = C00043316

Metabolite InformationStructural formula
Name Bisisodiospyrin
Formula C44H26O12
Mw 746.1424263
CAS RN 30276-87-0
C_ID C00043316 ,
InChIKey BAMHQETWRACUHR-UHFFFAOYSA-N
InChICode InChI=1S/C44H26O12/c1-15-9-21-35(43(55)33(15)31-17(3)11-27(49)37-23(45)5-7-25(47)39(31)37)29(51)13-19(41(21)53)20-14-30(52)36-22(42(20)54)10-16(2)34(44(36)56)32-18(4)12-28(50)38-24(46)6-8-26(48)40(32)38/h5-14,49-50,55-56H,1-4H3
SMILES c1(c(cc2c(c1O)C(=O)C=C(C2=O)C1=CC(=O)c2c(cc(c(c2O)c2c(cc(c3c2C(=O)C=CC3=O)O)C)C)C1=O)C)c1c(cc(c2c1C(=O)C=CC2=O)O)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeEbenaceaeDiospyros japonica Ref.
PlantaeEbenaceaeDiospyros lotus Ref.
PlantaeEbenaceaeDiospyros maingayi Ref.
PlantaeEbenaceaeDiospyros morrisiana Ref.
PlantaeEbenaceaeDiospyros usambarensis Ref.
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