input word = C00020850

Metabolite InformationStructural formula
Name Acrorepiolide
Formula C19H24O7
Mw 364.15220312
CAS RN 79331-12-7
C_ID C00020850 ,
InChIKey DGPKYTSMLWPRJT-UHFFFAOYNA-N
InChICode InChI=1S/C19H24O7/c1-8-5-12(25-17(22)9(2)7-20)14-10(3)18(23)26-16(14)15-11(8)6-13(21)19(15,4)24/h11-16,20-21,24H,1-3,5-7H2,4H3/t11-,12+,13+,14-,15-,16+,19-/m0/s1
SMILES [C@@H]12[C@@H]([C@H]3[C@H]([C@@H](CC1=C)OC(=O)C(=C)CO)C(=C)C(=O)O3)[C@@]([C@@H](C2)O)(C)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeAcroptilon repens Ref.
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