input word = C00059308

Metabolite InformationStructural formula
Name Neosarmentol III
Formula C13H18O2
Mw 206.13067982
CAS RN 1160937-78-9
C_ID C00059308
InChIKey LAWZLCWTUOWRIB-LBPRGKRZSA-N
InChICode InChI=1S/C13H18O2/c1-13(2)7-11(15)6-10-5-9(8-14)3-4-12(10)13/h5-6,12,14H,3-4,7-8H2,1-2H3/t12-/m0/s1
SMILES CC1(C)CC(=O)C=C2C=C(CO)CCC21
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeCrassulaceaeSedum sarmentosum Ref.
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