Concept information
Preferred term
(3r,4r,5r)-3-[(e)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy-1,4,5-trihydroxycyclohexane-1-carboxylic acid
Type
-
http://www.irandoc.ac.ir/onto/irandoc-meta/Concept
Broader concept
charge
- 0
formula
- C16H18O9
inchi
- InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)/b4-2+/t11-,12-,14-,16?/m1/s1
inchikey
- CWVRJTMFETXNAD-PCNKEKKESA-N
mass
- 354.311
monoisotopicmass
- 354.09508
smiles
- O([C@@H]1CC(O)(C[C@@H](O)[C@H]1O)C(O)=O)C(=O)/C=C/C2=CC(O)=C(O)C=C2
subset
- 2_STAR
synonym EXACT
- (3R,4R,5R)-3-[(E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy-1,4,5-trihydroxycyclohexane-1-carboxylic acid
In other languages
URI
http://www.irandoc.acir/onto/irandoc/CHEBI:182187
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