input word = C00003057

Metabolite InformationStructural formula
Name Pyrethrin II
Formula C22H28O5
Mw 372.193674
CAS RN 121-29-9
C_ID C00003057 ,
InChIKey VJFUPGQZSXIULQ-JYIDZNFRNA-N
InChICode InChI=1S/C22H28O5/c1-7-8-9-10-15-14(3)18(12-17(15)23)27-21(25)19-16(22(19,4)5)11-13(2)20(24)26-6/h7-9,11,16,18-19H,1,10,12H2,2-6H3/b9-8-,13-11+/t16-,18-,19-/m0/s1
SMILES C1([C@H]([C@H]1C(=O)O[C@@H]1C(=C(C(=O)C1)C/C=C\C=C)C)/C=C(\C)/C(=O)OC)(C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeTanacetum cinerariifolium Ref.
PlantaePaeoniaceaePaeonia albiflora Ref.
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OrganismTanacetum cinerariifolium
ReferenceHarborne,Phytochemical Dictionary Second Edition,Taylor and Francis,(1999),Chapter48