input word = C00022784

Metabolite InformationStructural formula
Name 2alpha,3alpha,4beta,15,16-Pentahydroxy-ent-cleroda-13Z-ene
Formula C20H36O5
Mw 356.25627426
CAS RN 120838-04-2
C_ID C00022784 ,
InChIKey YSUHEZZGWKTCBQ-KSJJWJKONA-N
InChICode InChI=1S/C20H36O5/c1-13-5-9-19(3)16(11-15(23)17(24)20(19,4)25)18(13,2)8-6-14(12-22)7-10-21/h7,13,15-17,21-25H,5-6,8-12H2,1-4H3/b14-7-/t13-,15-,16-,17-,18+,19-,20+/m1/s1
SMILES [C@@H]1([C@H]([C@@]([C@]2([C@H](C1)[C@@]([C@@H](CC2)C)(C)CC/C(=C/CO)/CO)C)(O)C)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeBaccharis boliviensis Ref.
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