input word = C00011419

Metabolite InformationStructural formula
Name [R-[R*,R*-(Z,E,E,E)]]-1-(3,3-Dimethyloxiranyl)-9-hydroxy-3,7-dimethyl-3,5,7-nonatrienyl ester 2-methyl-2-butenoic acid
Formula C20H30O4
Mw 334.21440945
CAS RN 83161-55-1
C_ID C00011419 ,
InChIKey XAAKIOMLMOMUSW-ZVGNSDCSNA-N
InChICode InChI=1S/C20H30O4/c1-7-16(4)19(22)23-17(18-20(5,6)24-18)13-15(3)10-8-9-14(2)11-12-21/h7-11,17-18,21H,12-13H2,1-6H3/b9-8+,14-11+,15-10+,16-7-/t17-,18-/m1/s1
SMILES C1([C@H](O1)[C@@H](C/C(=C/C=C/C(=C/CO)/C)/C)OC(=O)/C(=C\C)/C)(C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
--Stomanthes africanus Ref.
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