input word = C00019893

Metabolite InformationStructural formula
Name (-)-2beta-(2zeta-Hydroperoxy-3-methylbut-3-enyl)-2'-deoxybruceol
Formula C24H28O6
Mw 412.18858863
CAS RN 160663-86-5
C_ID C00019893 ,
InChIKey NVEOQGPEFJKASY-NPKQHKDINA-N
InChICode InChI=1S/C24H28O6/c1-12(2)16(30-26)10-15-20-14-8-9-24(15,5)29-22-13-6-7-19(25)27-17(13)11-18(21(20)22)28-23(14,3)4/h6-7,11,14-16,20,26H,1,8-10H2,2-5H3/t14-,15-,16+,20-,24+/m1/s1
SMILES c12c3cc4c(c1O[C@@]1([C@@H]([C@H]2[C@H](C(O3)(C)C)CC1)C[C@@H](C(=C)C)OO)C)ccc(=O)o4
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeRutaceaeEriostemon myoporoides Ref.
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