input word = C00021007

Metabolite InformationStructural formula
Name Isolipidiol
Formula C15H22O4
Mw 266.15180919
CAS RN 30825-68-4
C_ID C00021007 ,
InChIKey LWHRXFOPIDTJSG-UOZJTBNWNA-N
InChICode InChI=1S/C15H22O4/c1-6-4-11(17)13-8(3)15(18)19-14(13)12-7(2)10(16)5-9(6)12/h7-14,16-17H,1,4-5H2,2-3H3/t7-,8+,9+,10+,11+,12+,13-,14+/m1/s1
SMILES [C@@H]12[C@@H]([C@H]3[C@@H]([C@H](CC1=C)O)[C@@H](C(=O)O3)C)[C@@H]([C@H](C2)O)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeMacroclinidium trilobum Ref.
PlantaeAsteraceaeYoungia japonica (L.) DC. Ref.
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