Concept information
Preferred term
1،3 دی کافئوئیلکینیک اسید
Type
-
http://www.irandoc.ac.ir/onto/irandoc-meta/Concept
Broader concept
charge
- 0
formula
- C25H24O12
has_functional_parent
has_role
inchi
- InChI=1S/C25H24O12/c26-15-5-1-13(9-17(15)28)3-7-21(31)36-20-12-25(24(34)35,11-19(30)23(20)33)37-22(32)8-4-14-2-6-16(27)18(29)10-14/h1-10,19-20,23,26-30,33H,11-12H2,(H,34,35)/b7-3+,8-4+/t19-,20-,23+,25-/m1/s1
inchikey
- YDDUMTOHNYZQPO-RVXRWRFUSA-N
is_conjugate_acid_of
mass
- 516.45090
monoisotopicmass
- 516.12678
smiles
- O[C@@H]1C[C@](C[C@@H](OC(=O)/C=C/c2ccc(O)c(O)c2)[C@H]1O)(OC(=O)/C=C/c1ccc(O)c(O)c1)C(O)=O
subset
- 3_STAR
synonym EXACT
- (1R,3R,4S,5R)-1,3-bis{[(2E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy}-4,5-dihydroxycyclohexane-1-carboxylic acid
synonym RELATED
- 1,5-Dicaffeoylquinic acid
- Cynarin
In other languages
-
English
URI
http://www.irandoc.acir/onto/irandoc/CHEBI:520
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