input word = C00035782

Metabolite InformationStructural formula
Name 15-O-Isovaleroyl-2alpha-hydroxyamphoricarpolide
Formula C20H28O6
Mw 364.18858863
CAS RN 791856-27-4
C_ID C00035782 ,
InChIKey ADKOPKQXCWUNLB-REENCYPNNA-N
InChICode InChI=1S/C20H28O6/c1-5-9(2)19(23)25-8-13-15-14(17(22)16(13)21)10(3)6-7-12-11(4)20(24)26-18(12)15/h9,12-18,21-22H,3-8H2,1-2H3/t9-,12+,13+,14+,15-,16-,17-,18+/m1/s1
SMILES [C@@H]12[C@H]3[C@H](C(=C)CC[C@H]1C(=C)C(=O)O2)[C@H]([C@@H]([C@H]3COC(=O)[C@H](C)CC)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeAmphoricarpos neumayeri Ref.
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