input word = C00056180

Metabolite InformationStructural formula
Name Totaryl acetate
Formula C22H32O2
Mw 328.24023027
CAS RN 15340-82-6
C_ID C00056180
InChIKey ORVBSFQTFRBNRP-SIKLNZKXSA-N
InChICode InChI=1S/C22H32O2/c1-14(2)20-16-8-11-19-21(4,5)12-7-13-22(19,6)17(16)9-10-18(20)24-15(3)23/h9-10,14,19H,7-8,11-13H2,1-6H3/t19-,22+/m0/s1
SMILES CC(=O)Oc1ccc2c(c1C(C)C)CC[C@H]1C(C)(C)CCC[C@]21C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaePodocarpaceaePodocarpus gnidioides Ref.
PlantaePodocarpaceaePodocarpus sylvestris Ref.
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OrganismPodocarpus sylvestris
ReferenceCoulerie, P. et al., Chem. Biodiv., 12, (2015), 841-856.