input word = C00012447

Metabolite InformationStructural formula
Name (-)-Neocaucalol diacetate
Neocaucalol diacetate
Formula C19H30O5
Mw 338.20932407
CAS RN 98243-51-7
C_ID C00012447 ,
InChIKey LLDZPKVTWNOHBD-VAWYXSNFNA-N
InChICode InChI=1S/C19H30O5/c1-12-7-8-16-19(6,24-16)10-9-15(22-13(2)20)18(4,5)17(11-12)23-14(3)21/h11,15-17H,7-10H2,1-6H3/b12-11+/t15-,16+,17+,19-/m1/s1
SMILES CC(=O)OC1/C=C(C)CCC2OC2(C)CCC(OC(C)=O)C1(C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeApiaceaeCaucalis scabra Ref.
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