input word = C00010374

Metabolite InformationStructural formula
Name 3,3,6-Trimethyl-5-heptene-1,2,4-triol
Formula C16H26O6
Mw 314.17293856
CAS RN 83117-67-3
C_ID C00010374 ,
InChIKey YCPRKSWWEMVOBC-UHFFFAOYNA-N
InChICode InChI=1S/C16H26O6/c1-10(2)8-14(21-12(4)18)16(6,7)15(22-13(5)19)9-20-11(3)17/h8,14-15H,9H2,1-7H3/t14-,15-/m0/s1
SMILES C([C@@H](C([C@H](C=C(C)C)OC(=O)C)(C)C)OC(=O)C)OC(=O)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeCalea oxylepis Ref.
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OrganismCalea oxylepis
ReferenceBohlmann,Phytochem.,21,(1982),1164