| 2D Structure | |
| CID | 8742 |
| Target | Arfgap1 , CFTR , Chain A, 3 , Chain A, 3-phosphoshikimate 1-carboxyvinyltransferase (E. coli) |
| IUPAC Name | (3R,4S,5R)-3,4,5-trihydroxycyclohexene-1-carboxylic acid |
| InChI | InChI=1S/C7H10O5/c8-4-1-3(7(11)12)2-5(9)6(4)10/h1,4-6,8-10H,2H2,(H,11,12)/t4-,5-,6-/m1/s1 |
| InChI Key | JXOHGGNKMLTUBP-HSUXUTPPSA-N |
| Canonical SMILES | C1C(C(C(C=C1C(=O)O)O)O)O |
| Isomeric SMILES | C1[C@H]([C@@H]([C@@H](C=C1C(=O)O)O)O)O |
| Molecular Formula | C7H10O5 |
| Molecular Weight | 174.15 |
| synonyms | ['shikimic acid', '138-59-0', 'L-Shikimic acid', '(3R,4S,5R)-3,4,5-TRIHYDROXYCYCLOHEX-1-ENE-1-CARBOXYLIC ACID', '1-cyclohexene-1-carboxylic acid, 3,4,5-trihydroxy-, (3R,4S,5R)-', '(3R,4S,5R)-3,4,5-Trihydroxycyclohex-1-enecarboxylic acid', '(3R,4S,5R)-3,4,5-trihydroxycyclohexene-1-carboxylic acid', 'CCRIS 7681', 'HSDB 3537', '3alpha,4alpha,5beta-Trihydroxy-1-cyclohexene-1-carboxylic acid', 'Bracken fern toxic component', 'Shicimic Acid', 'EINECS 205-334-2', '29MS2WI2NU', 'NSC 59257', 'VEROCHIC', 'CHEBI:16119', '1-Cyclohexene-1-carboxylic acid, 3,4,5-trihydroxy-, (3R-(3alpha,4alpha,5beta))-', 'SHIKIMIC ACID [MI]', 'SHIKIMIC ACID [HSDB]', 'SHIKIMIC ACID [IARC]', '[3R-(3alpha,4alpha,5beta)]-3,4,5-Trihydroxy-1-cyclohexene-1-carboxylic acid', 'DTXSID4032039', 'EC 205-334-2', 'NSC-59257', 'SHIKIMIC ACID (IARC)', '1-cyclohexene-1-carboxylic acid, 3,4,5-trihydroxy-', 'Shikimates', '(3r,4s,5r)-3,4,5-trihydroxy-1-cyclohexene-1-carboxylic acid', 'Acid, Shikimic', 'SHIKIMIC ACID (CONSTITUENT OF CRANBERRY LIQUID PREPARATION) [DSC]', 'Shikimic Acid Derivatives', '(3R-(3alpha,4alpha,5beta))-3,4,5-trihydroxy-1-cyclohexene-1-carboxylic acid', '() Shikimic acid', 'SHIKIMIC ACID [INCI]', 'DTXCID2012039', '3,4,5Trihydroxy1cyclohexene1carboxylic acid', '(3R,4S,5R)3,4,5Trihydroxycyclohex1enecarboxylic acid', '3alpha,4alpha,5betaTrihydroxy1cyclohexene1carboxylic acid', 'SHIKIMIC ACID (CONSTITUENT OF CRANBERRY LIQUID PREPARATION)', '1Cyclohexene1carboxylic acid, 3,4,5trihydroxy, (3R(3alpha,4alpha,5beta))', '1-Cyclohexene-1-carboxylic acid, 3,4,5-trihydroxy-, (3R-(3alpha,4alpha,5beta))-(9CI)', 'shikimate', '(-)-Shikimic acid', 'ShikimicAcid', '(-)-Shikimate', 'MFCD00066278', '106210-02-0', 'CHEMBL290345', 'HYDROTRIS(3-PHENYLPYRAZOL-1-YL)BORATE THALLIUM SALT', '3,4,5-Trihydroxy-1-cyclohexenecarboxylic acid', '(3R,4S,5R)-(-)-3,4,5-Trihydroxy-1-cyclohexenecarboxylic acid', 'C7H10O5', 'SMR001306700', 'SR-01000632403', 'UNII-29MS2WI2NU', 'Skikimate', 'L-Shikimate', '2aay', '4guj', 'Spectrum_001232', '1we2', '2aa9', 'SpecPlus_000488', 'Spectrum2_001508', 'Spectrum3_001541', 'Spectrum4_001853', 'Spectrum5_000386', 'Shikimic acid (Standard)', 'Shikimic acid, >=99%', 'bmse000114', 'SCHEMBL43377', 'BSPBio_002982', 'KBioGR_002287', 'KBioSS_001712', 'MLS002207031', 'MLS004256600', 'DivK1c_006584', 'SPECTRUM1502256', 'SPBio_001555', 'MEGxp0_001939', 'HY-N0130R', 'KBio1_001528', 'KBio2_001712', 'KBio2_004280', 'KBio2_006848', 'KBio3_002482', '(4S,3R,5R)-3,4,5-trihydroxycyclohex-1-enecarboxylic acid', 'Shikimic acid, analytical standard', 'HY-N0130', 'MSK40056', 'BDBM50281998', 'CCG-38884', 'AKOS004119897', 'AC-8010', 'FS06909', 'SDCCGMLS-0066740.P001', 'SMP1_000326', 'NCGC00142601-01', 'NCGC00142601-02', '1ST40056', 'AS-13905', 'CS-0007856', 'NS00079355', 'S0038', 'C00493', 'EN300-208879', 'Q410830', 'SR-01000632403-1', 'SR-01000632403-4', 'SR-01000632403-5', '(-)-3,4,5-Trihydroxy-1-cyclohexene-1-carboxylic acid', 'Z1198149969', '(3R,4S,5R)-3,4,5-trihydroxycyclohexene-1-carboxylicacid', 'B1A53F8A-8664-405D-8370-A9785ADD2D0B', '(3R,4S,5R)-(-)-3,4,5-Trihydroxy-1-cyclohexene-1-carboxylic Acid', '(3R,4S,5R))-3,4,5-Trihydroxy-1-cyclohexenecarboxylic acid;L-Shikimic acid', '1-Cyclohexene-1-carboxylic acid, 3,4,5-trihydroxy-, (3R,4S,5R)- (9CI)', '[3R-(3 alpha,4 alpha,5 beta)]-3,4,5-Trihydroxy-1-cyclohexene-1-carboxylic acid', '1-Cyclohexene-1-carboxylic acid, 3,4,5-trihydroxy-, (3R-(3alpha,4alpha,5beta))', '1-Cyclohexene-1-carboxylic acid, 3,4,5-trihydroxy-, (3R-(3alpha,4alpha,5beta))- (9CI)', 'Shikimic acid [3R-(3alpha,4alpha,5beta)]-3,4,5-Trihydroxy-1-cyclohexene-1-carboxylic acid', 'InChI=1/C7H10O5/c8-4-1-3(7(11)12)2-5(9)6(4)10/h1,4-6,8-10H,2H2,(H,11,12)/t4-,5-,6-/m1/s'] |
From Pubchem