input word = C00021154

Metabolite InformationStructural formula
Name Amblyodiol
Formula C17H22O7
Mw 338.13655306
CAS RN 53915-43-8
C_ID C00021154 ,
InChIKey FQBICLSJXKAREH-XCFJCOTONA-N
InChICode InChI=1S/C17H22O7/c1-8-10-4-5-12(20)16(10,3)6-11-14(13(8)23-9(2)19)24-15(21)17(11,22)7-18/h4-5,8,10-11,13-14,18,22H,6-7H2,1-3H3/t8-,10-,11-,13+,14+,16-,17-/m0/s1
SMILES [C@@H]12[C@](C[C@H]3[C@H]([C@@H]([C@H]1C)OC(=O)C)OC(=O)[C@@]3(CO)O)(C(=O)C=C2)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeGaillardia amblyodon Ref.
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