input word = C00020097

Metabolite InformationStructural formula
Name Heritol
Formula C15H16O3
Mw 244.10994438
CAS RN 108295-47-2
C_ID C00020097 ,
InChIKey CNHPRYNNWGQLLZ-BSLZWUBRNA-N
InChICode InChI=1S/C15H16O3/c1-7-5-13-14(9(3)15(17)18-13)11-4-8(2)12(16)6-10(7)11/h4,6-7,13,16H,5H2,1-3H3/t7-,13+/m1/s1
SMILES CC1=C2c3cc(C)c(O)cc3[C@H](C)C[C@@H]2OC1=O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeMalvaceaeHeritiera littoralis Ref.
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OrganismHeritiera littoralis
ReferenceMiles,J. Org. Chem.,52,(1987),2930