input word = C00032453

Metabolite InformationStructural formula
Name Upunaphenol J
(-)-Upunaphenol J
Formula C56H38O12
Mw 902.23632668
CAS RN 879897-45-7
C_ID C00032453 ,
InChIKey SANBFURBONHFCE-JEHQLFSENA-N
InChICode InChI=1S/C56H38O12/c57-29-9-1-25(2-10-29)35-21-39-49(43(65)23-45-51(39)53(37-17-33(61)19-41(63)47(35)37)55(67-45)27-5-13-31(59)14-6-27)50-40-22-36(26-3-11-30(58)12-4-26)48-38(18-34(62)20-42(48)64)54-52(40)46(24-44(50)66)68-56(54)28-7-15-32(60)16-8-28/h1-24,53-66H/t53-,54-,55+,56+/m1/s1
SMILES c12c(C(=Cc3c4[C@@H]1[C@@H](Oc4cc(c3c1c3C=C(c4c([C@@H]5c3c(cc1O)O[C@H]5c1ccc(cc1)O)cc(cc4O)O)c1ccc(cc1)O)O)c1ccc(cc1)O)c1ccc(cc1)O)c(cc(c2)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeDipterocarpaceaeUpuna borneensis Ref.
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OrganismUpuna borneensis
ReferenceIto,Chem.Pharm.Bull.,55,(2007),1535