input word = C00022388

Metabolite InformationStructural formula
Name Isoforskolin
Coleonol B
Formula C22H34O7
Mw 410.23045344
CAS RN 64657-21-2
C_ID C00022388 ,
InChIKey CLOQVZCSBYBUPB-HBQIERAFNA-N
InChICode InChI=1S/C22H34O7/c1-8-19(5)11-14(25)22(27)20(6)13(24)9-10-18(3,4)16(20)15(28-12(2)23)17(26)21(22,7)29-19/h8,13,15-17,24,26-27H,1,9-11H2,2-7H3/t13-,15-,16-,17-,19-,20-,21+,22-/m0/s1
SMILES C1CC([C@H]2[C@]([C@H]1O)([C@@]1([C@@]([C@H]([C@H]2OC(=O)C)O)(O[C@](CC1=O)(C=C)C)C)O)C)(C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeEuphorbiaceaeExcoecaria cochinchinensis Ref.
PlantaeLamiaceaeColeus forskohlii WILLD.BRIQ. Ref.
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OrganismExcoecaria cochinchinensis
ReferenceWang,Helv. Chim. Acta,88,(2005),968