input word = C00050879

Metabolite InformationStructural formula
Name Isoborneol, acetate
Isobornyl acetate
Formula C12H20O2
Mw 196.14632988
CAS RN 125-12-2
C_ID C00050879
InChIKey KGEKLUUHTZCSIP-BEYHTBJANA-N
InChICode InChI=1/C12H20O2/c1-8(13)14-10-7-9-5-6-12(10,4)11(9,2)3/h9-10H,5-7H2,1-4H3/t9-,10-,12+/s2
SMILES CC(=O)O[C@H]1C[C@@H]2CC[C@@]1(C)C2(C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAnnonaceaeXylopia parviflora Ref.
PlantaeApiaceaeApium graveolens Ref.
PlantaeAsteraceaeArtemisia annua Ref.
PlantaeAsteraceaeArtemisia vulgaris Ref.
PlantaeAsteraceaeCyathocline purpurea Ref.
PlantaeAsteraceaeHelianthus annuus Ref.
PlantaeCupressaceaeChamaecyparis formosensis Ref.
PlantaeLabiataeOcimum kilimandscharicim Ref.
PlantaeLabiataePerilla frutescens Ref.
PlantaePinaceaePinus halepensis Ref.
PlantaePolygonaceaePolygonum minus Ref.
PlantaeTaxodiaceaeTaiwania cryptomerioides Ref.
PlantaeZingiberaceaeZingiber officinale Ref.
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