input word = C00049405

Metabolite InformationStructural formula
Name Tomenphantin B
Formula C19H22O6
Mw 346.14163844
CAS RN 220114-45-4
C_ID C00049405 ,
InChIKey NGGWPCQJJXMSHR-OFUDVEAYNA-N
InChICode InChI=1S/C19H22O6/c1-10(2)17(21)23-13-8-12(9-20)6-5-7-19(4)16(25-19)15-14(13)11(3)18(22)24-15/h6,9,13-16H,1,3,5,7-8H2,2,4H3/b12-6+/t13-,14+,15-,16+,19+/m0/s1
SMILES [C@H]12[C@@H]([C@H](C/C(=C\CC[C@@]3([C@@H]1O3)C)/C=O)OC(=O)C(=C)C)C(=C)C(=O)O2
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeElephantopus tomentosus Ref.
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