input word = C00057128

Metabolite InformationStructural formula
Name Monocaffeoyl(-)-tartaric acid
Formula C13H12O9
Mw 312.04813198
CAS RN 162990-62-7
C_ID C00057128
InChIKey SWGKAHCIOQPKFW-BOCAPUTCSA-N
InChICode InChI=1S/C13H12O9/c14-7-3-1-6(5-8(7)15)2-4-9(16)22-11(13(20)21)10(17)12(18)19/h1-5,10-11,14-15,17H,(H,18,19)(H,20,21)/b4-2+/t10-,11+/m1/s1
SMILES O=C(/C=C/c1ccc(O)c(O)c1)O[C@H](C(=O)O)[C@@H](O)C(=O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeCichorium intybus Ref.
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