input word = C00012199

Metabolite InformationStructural formula
Name Herbolide B
Formula C17H24O5
Mw 308.16237388
CAS RN 64562-24-9
C_ID C00012199 ,
InChIKey FIERCWGNGPBXJU-YKVZMCKINA-N
InChICode InChI=1S/C17H24O5/c1-9-5-6-14-17(4,22-14)15(20-11(3)18)8-12-10(2)16(19)21-13(12)7-9/h7,10,12-15H,5-6,8H2,1-4H3/b9-7+/t10-,12-,13-,14+,15-,17-/m0/s1
SMILES CC(=O)O[C@H]1C[C@H]2[C@H](C)C(=O)O[C@@H]2/C=C(C)CC[C@H]2O[C@]12C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeArtemisia herba alba Ref.
PlantaeAsteraceaeArtemisia herba-alba Ref.
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