input word = C00037388

Metabolite InformationStructural formula
Name Kleinioxanthrone 3
(-)-Kleinioxanthrone 3
Formula C31H42O5
Mw 494.30322445
CAS RN 438037-55-9
C_ID C00037388 ,
InChIKey KLZLSRCDCWZALP-UHFFFAOYNA-N
InChICode InChI=1S/C31H42O5/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-19-27(34)36-31-23-17-16-18-25(32)28(23)30(35)29-24(31)20-22(2)21-26(29)33/h16-18,20-21,31-33H,3-15,19H2,1-2H3/t31-/m1/s1
SMILES CCCCCCCCCCCCCCCC(=O)OC1c2cccc(O)c2C(=O)c2c(O)cc(C)cc21
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeFabaceaeCassia kleinii W&A Ref.
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