input word = C00020503

Metabolite InformationStructural formula
Name Acroptin
Formula C19H22O6
Mw 346.14163844
CAS RN 85011-56-9
C_ID C00020503 ,
InChIKey OYBRIQSXJOQPQF-RUUAKXAENA-N
InChICode InChI=1S/C19H22O6/c1-8-5-12(21)14-9(2)6-13(24-18(22)10(3)7-20)16-11(4)19(23)25-17(16)15(8)14/h12-17,20-21H,1-7H2/t12-,13+,14+,15-,16-,17-/m1/s1
SMILES C1(=O)C(=C)[C@H]2[C@H](O1)[C@H]1[C@@H](C(=C)C[C@@H]2OC(=O)C(=C)CO)[C@@H](CC1=C)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeAcroptilon repens Ref.
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