| 2D Structure | |
| CID | 6508 |
| Target | APP |
| IUPAC Name | (3R,5R)-1,3,4,5-tetrahydroxycyclohexane-1-carboxylic acid |
| InChI | InChI=1S/C7H12O6/c8-3-1-7(13,6(11)12)2-4(9)5(3)10/h3-5,8-10,13H,1-2H2,(H,11,12)/t3-,4-,5?,7?/m1/s1 |
| InChI Key | AAWZDTNXLSGCEK-LNVDRNJUSA-N |
| Canonical SMILES | C1C(C(C(CC1(C(=O)O)O)O)O)O |
| Isomeric SMILES | C1[C@H](C([C@@H](CC1(C(=O)O)O)O)O)O |
| Molecular Formula | C7H12O6 |
| Molecular Weight | 192.17 |
| synonyms | ['quinate', '(1S,3R,4S,5R)-1,3,4,5-tetrahydroxycyclohexane-1-carboxylic acid', 'CHEBI:26490', '7729-33-1', 'quinic acid', '77-95-2', 'D-(-)-Quinic acid', '(-)-quinic acid', 'Chinic acid', 'Kinic acid', 'Chinasaure', 'D-QUINIC ACID', 'D(-)-Quinic acid', 'L-Quinic acid', 'L-Quinate', 'MFCD00003864', '(3r,5r)-1,3,4,5-tetrahydroxycyclohexanecarboxylic acid', '(3R,5R)-1,3,4,5-tetrahydroxycyclohexane-1-carboxylic acid', 'Rel-Quinic Acid', 'CHEBI:17521', 'NSC1115', 'SpecPlus_000419', 'NSC59258', '(1S,3R,4S,5R)-1,3,4,5-tetrahydroxycyclohexanecarboxylic acid', '(-)-1,3,4,5-Tetrahydroxycyclohexanecarboxylic acid', 'DivK1c_006515', '058C04BGYI', 'Cyclohexanecarboxylic acid, 1,3,4,5-tetrahydroxy-, (-)-', 'NSC-59258', 'Cyclohexanecarboxylic acid, 1,3,4,5-tetrahydroxy-, (1R-(1-alpha,3-alpha,4-alpha,5-beta))-', 'Cyclohexanecarboxylic acid, 1,3,4,5-tetrahydroxy-, (1R-(1alpha,3alpha,4alpha,5beta))-', 'SDCCGMLS-0066613.P001', '1,3,4,5-Tetrahydroxycyclohexanecarboxylic acid (1R-(1alpha,3alpha,4alpha,5beta)', 'Cyclohexanecarboxylic acid, 1,3,4,5-tetrahydroxy-, (1theta-(1alpha,3alpha,4alpha,5beta))-', '1L-1(OH),3,4/5-Tetrahydroxycyclohexanecarboxylic acid', 'Quinicacid', 'Cyclohexanecarboxylic acid, 1,3,4,5-tetrahydroxy-, (1alpha,3R,4alpha,5R)-', 'D-(-)-Kinic Acid', 'D-(-)-Chinic Acid', 'EINECS 201-072-8', 'NSC 59258', 'UNII-058C04BGYI', 'Chinate', 'Kinate', '1L-1(OH),3,4/5-Tetrahydroxycyclohexanecarboxylate', '4gui', '4iuo', 'Cyclohexanecarboxylic acid, 1,3,4,5-tetrahydroxy-, (1.alpha.,3R,4.alpha.,5R)-', '(-)Quinic acid', 'QIC', 'D-(-)-Quinic-acid', 'Spectrum_001413', 'Spectrum2_001790', 'Spectrum3_001349', 'Spectrum4_001867', 'Spectrum5_000434', 'QUINIC ACID [MI]', 'bmse000306', 'SCHEMBL39556', 'BSPBio_003137', 'KBioGR_002336', 'KBioSS_001893', 'SPECTRUM310018', 'MLS002207201', 'QUINIC ACID [USP-RS]', 'QUINIC ACID [WHO-DD]', 'SPBio_001719', 'CHEMBL465398', 'MEGxp0_001735', 'SCHEMBL1286207', 'SCHEMBL7923331', 'D-(-)-Quinic acid, 98%', 'ACon1_001963', 'D-(-)-Quinic acid (Standard)', 'HY-N0464R', 'KBio1_001459', 'KBio2_001893', 'KBio2_004461', 'KBio2_007029', 'KBio3_002357', 'DTXSID70998288', 'HMS3885A12', 'HY-N0464', 'MSK40055', 'NSC-1115', 'BBL033519', 'BDBM50485632', 'CCG-38438', 's3886', 'STK801928', '(-) Quinic acid, analytical standard', 'AKOS005622501', 'FQ15911', 'NCGC00178246-01', 'NCGC00178246-02', '1ST40055', 'BP-12304', 'DA-62619', 'PD087258', 'SMR001306762', 'VS-12119', 'CS-0008991', 'Q0009', 'C00296', 'D-(-)-Quinic acid, purum, >=98.0% (T)', 'EN300-197153', 'H10089', 'Q424931', '883DE888-EC82-454C-B69C-8B1F9AC6DAA9', 'Z1255382952', '(1R,3R,4R,5R)-(-)-Tetrahydroxycyclohexanecarboxylic acid', '(3R,5R)-1,3,4,5-tetrahydroxycyclohexane-1-carboxylicacid', '(1|A,3R,4|A,5R)-1,3,4,5-Tetrahydroxycyclohexanecarboxylic acid', '(3R,5R)-1,3,4,5-tetrakis(oxidanyl)cyclohexane-1-carboxylic acid', 'Quinic acid, United States Pharmacopeia (USP) Reference Standard', '(-)-QUINIC ACID (CONSTITUENT OF CRANBERRY LIQUID PREPARATION) [DSC]', '(1alpha,3R,4alpha,5R)-1,3,4,5-Tetrahydroxycyclohexanecarboxylic acid', 'Quinic Acid, Pharmaceutical Secondary Standard; Certified Reference Material', 'Cyclohexanecarboxylic acid,3,4,5-tetrahydroxy-, (1.alpha.,3.alpha.,4.alpha.,5.beta.)-', 'Cyclohexanecarboxylic acid, 1,3,4,5-tetrahydroxy-, (1.alpha., 3.alpha.,4.alpha.,5.beta.)-'] |
From Pubchem