input word = C00023462

Metabolite InformationStructural formula
Name Neoconcinndiol hydroperoxide
Formula C20H34O4
Mw 338.24570957
CAS RN 64504-60-5
C_ID C00023462 ,
InChIKey UZFSKYTVNZVLCY-KVIJAOMXNA-N
InChICode InChI=1S/C20H34O4/c1-7-18(5,21)12-13-20(22)14(2)8-9-16-15(17(3,4)24-23)10-11-19(16,20)6/h7,10,14,16,21-23H,1,8-9,11-13H2,2-6H3/t14-,16+,18-,19+,20-/m0/s1
SMILES [C@]12([C@H](CC[C@@H]([C@]1(CC[C@](C=C)(O)C)O)C)C(=CC2)C(C)(C)OO)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
--Laurencia snyderae Ref.
--Laurencia snyderiae Ref.
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OrganismLaurencia snyderae
ReferenceHoward,J. Am. Chem. Soc.,99,(1977),6440