input word = C00047672

Metabolite InformationStructural formula
Name 4-Methylene-5beta-hydroperoxyovatodiolide
(+)-4-Methylene-5beta-hydroperoxyovatodiolide
Formula C20H24O6
Mw 360.1572885
CAS RN 1037412-83-1
C_ID C00047672 ,
InChIKey VTUGHLCKKNSTAF-DQINJFGCNA-N
InChICode InChI=1S/C20H24O6/c1-11-8-15-10-14(20(22)24-15)5-7-17(26-23)12(2)4-6-16-13(3)19(21)25-18(16)9-11/h9-10,15-18,23H,2-8H2,1H3/b11-9+/t15-,16-,17-,18-/m1/s1
SMILES [C@H]1(CCC2=C[C@H](OC2=O)C/C(=C/[C@@H]2[C@H](CCC1=C)C(=C)C(=O)O2)/C)OO
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeLabiataeIsodon sculponeatus Ref.
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