Concept information
Preferred term
3 O Coumaroylquinic acid
Type
-
http://www.irandoc.ac.ir/onto/irandoc-meta/Concept
Broader concept
charge
- 0
formula
- C16H18O8
inchi
- InChI=1S/C16H18O8/c17-10-4-1-9(2-5-10)3-6-13(19)24-12-8-16(23,15(21)22)7-11(18)14(12)20/h1-6,11-12,14,17-18,20,23H,7-8H2,(H,21,22)/b6-3+/t11-,12-,14+,16-/m1/s1
inchikey
- BMRSEYFENKXDIS-QHAYPTCMSA-N
mass
- 338.312
monoisotopicmass
- 338.10017
smiles
- O([C@@H]1C[C@](O)(C[C@@H](O)[C@@H]1O)C(O)=O)C(=O)/C=C/C2=CC=C(O)C=C2
subset
- 2_STAR
synonym EXACT
- (1R,3R,4S,5R)-1,3,4-trihydroxy-5-[(E)-3-(4-hydroxyphenyl)prop-2-enoyl]oxycyclohexane-1-carboxylic acid
In other languages
-
English
URI
http://www.irandoc.acir/onto/irandoc/CHEBI:167530
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