input word = C00003187

Metabolite InformationStructural formula
Name Shiromodiol diacetate
Formula C19H30O5
Mw 338.20932407
CAS RN 20071-58-3
C_ID C00003187 ,
InChIKey DRGFRBPYLMWXJS-WRVLICEVNA-N
InChICode InChI=1S/C19H30O5/c1-11(2)16-15(22-13(4)20)10-12(3)8-7-9-19(6)18(24-19)17(16)23-14(5)21/h8,11,15-18H,7,9-10H2,1-6H3/b12-8+/t15-,16-,17-,18-,19-/m1/s1
SMILES CC(=O)O[C@@H]1[C@H](C(C)C)[C@H](OC(C)=O)C/C(C)=C/CC[C@@]2(C)O[C@H]12
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeLauraceaeLindera triloba Ref.
PlantaeLauraceaeParabenzoin trilobum Nakai. Ref.
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