input word = C00057971

Metabolite InformationStructural formula
Name Sugetriol triacetate
Formula C21H30O6
Mw 378.20423869
CAS RN 17928-62-0
C_ID C00057971
InChIKey LCYMMMXHRHJXJB-ZHOQLOPFSA-N
InChICode InChI=1S/C21H30O6/c1-10-17(26-13(4)23)9-21-11(2)16(25-12(3)22)8-15(20(21,6)7)19(18(10)21)27-14(5)24/h11,15-17,19H,8-9H2,1-7H3/t11-,15-,16+,17+,19+,21+/m1/s1
SMILES CC(=O)O[C@H]1C[C@@]23C(=C1C)[C@@H](OC(C)=O)[C@@H](C[C@H](OC(C)=O)[C@H]2C)C3(C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeCyperaceaeCyperus rotundus Ref.
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